NPs Basic Information

Name
Acetaminophen
Molecular Formula C8H9NO2
IUPAC Name*
N-(4-hydroxyphenyl)acetamide
SMILES
CC(=O)NC1=CC=C(C=C1)O
InChI
InChI=1S/C8H9NO2/c1-6(10)9-7-2-4-8(11)5-3-7/h2-5,11H,1H3,(H,9,10)
InChIKey
RZVAJINKPMORJF-UHFFFAOYSA-N
Synonyms
acetaminophen; Paracetamol; 4-Acetamidophenol; 103-90-2; N-(4-Hydroxyphenyl)acetamide; Tylenol; APAP; Panadol; N-Acetyl-p-aminophenol; 4'-Hydroxyacetanilide; Acetaminofen; Datril; p-Hydroxyacetanilide; p-Acetamidophenol; Algotropyl; Lonarid; Naprinol; Doliprane; Injectapap; Acamol; Acenol; Anelix; Multin; p-Acetaminophenol; Abensanil; Acetagesic; Acetalgin; Biocetamol; Clixodyne; Gelocatil; Liquagesic; Pyrinazine; Servigesic; Acephen; Alvedon; Anaflon; Apamide; Dymadon; Febridol; Febrilix; Febrolin; Finimal; Homoolan; Lestemp; Paracet; Tabalgin; Tralgon; Tussapap; Valadol; Valgesic; Vermidon; Alpiny; Amadil; Anhiba; Calpol; Dirox; Eneril; Fendon; Hedex; Lyteca; Neopap; Pacemo; Panets; Parmol; Tapar; Tempra; Acetamide, N-(4-hydroxyphenyl)-; Paracetamolo; Dafalgan; Dolprone; Momentum; Ortensan; Paldesic; Banesin; Captin; Disprol; Enelfa; Salzone; Exdol; p-Acetylaminophenol; Febro-Gesic; NEBS; Paracetamolum; Dolgesic; Elixodyne; Febrectal; Phenaphen; Tempanal; Abenol; Apacet; Apadon; Cetadol; Fensum; Janupap; Minoset; Napafen; Neodol; Nobedon; Pacemol; Panodil; Parapan; Pedric; Phendon; Rounox; Suppap; Korum; Pinex; Temlo; 4-(Acetylamino)phenol; Ben-u-ron; Dial-A-Gesic; Anacin-3; Calmanticold; Codoliprane; Demogripal; Dolegrippin; Doloreduct; Dristancito; Duracetamol; Eu-Med; Grippostad; Gynospasmine; Medocodene; Paedialgon; Paracetanol; Parakapton; Pediapirin; Phenipirin; Phogoglandin; Predualito; Sanicopyrine; Scentalgyl; Sunetheton; Tachiprina; Termalgine; Treuphadol; Abrolet; Acertol; Acetamol; Acetofen; Afebrin; Afebryl; Aferadol; Algesidal; Algomol; Alpinyl; Analter; Antidol; Apitrelal; Atralidon; Babikan; Bacetamol; Cadafen; Calapol; Causalon; Cefalex; Codabrol; Codalgin; Codapane; Codicet; Codisal; Cofamol; Cosutone; Cuponol; Curadon; Custodial; Darocet; Daygrip; Deminofen; Democyl; Desfebre; Dimindol; Dolefin; Dolofugin; Dolorfug; Dolorstop; Dolotec; Dorocoff; Dularin; Durapan; Ecosetol; Excipain; Fanalgic; Farmadol; Febranine; Febrectol; Febricet; Febrinol; Fepanil; Finiweh; Fluparmol; Geluprane; Ildamol; Inalgex; Infadrops; Kataprin; Labamol; Lekadol; Lemgrip; Lupocet; Magnidol; Malidens; Maxadol; Mexalen; Minafen; Miralgin; Nealgyl; Neodolito; Neotrend; Neuridon; Nodolex; Ofirmev; Oralgan; Oxycocet; Pacimol; Panacete; Panadeine; Panadiene; Panaleve; Panamax; Panasorbe; Panofen; Pantalgin; Paracemol; Paracenol; Paracetol; Paracin; Paracod; Paracodol; Parador; Paradrops; Paralen; Paralief; Paralink; Paralyoc; Paramol; Paramolan; Paranox; Parasedol; Parasin; Paraspen; Parcetol; Parogal; Pediatrix; Perfalgan; Piramin; Pirinasol; Polmofen; Predimol; Prontina; Puernol; Pulmofen; Pyrigesic; Pyromed; Remedol; Rivalgyl; Rubophen; Rupemol; Sanicet; Schmerzex; Sedalito; Semolacin; Seskamol; Setakop; Setamol; Sifenol; Sinaspril; Sinedol; Stanback; Stopain; Supofen; Tazamol; Termacet; Termalgin; Termofren; Titralgan; Tricoton; Upsanol; Utragin; Veralgina; Viruflu; Vivimed; Zatinol; Abrol; Algina; Anapap; Andox; Asetam; Asomal; Aspac; Asplin; Benmyo; Curpol; Dhamol; Dolcor; Dolko; Dresan; Dypap; Febrex; Febrin; Lemsip; Malgis; Oltyl; Paceco; Pacet; Paedol; Painex; Pamol; Panex; Parake; Paroma; Plicet; Prodol; Reliv; Scanol; Setol; Sinmol; Tiffy; Tylex; Tylol; Tymol; Verpol; Volpan; Zolben; NeoCitran; NilnOcen; Nina; RubieMol; Vips; Supadol mono; Treupel mon; Bickie-mol; Fortalidon P; Gattaphen T; Gripin Bebe; Influbene N; Lonarid Mono; Panadeine Co; Dymadon Co; Toximer P; Treupel N; Accu-Tap; 4-Acetaminophenol; Helon N; Malex N; Spalt N; Tylex CD; N-Acetyl-4-aminophenol; SK-Apap; Paracetamole; Conacetol; Darvocet; Empracet; Panasorb; A-Per; Apamid; Parelan; Prompt; Vicodin; Fevor; Freka-cetamol; Codisal Forte; Croix Blanche; Dolorol Forte; Dymadon Forte; Junior Disprol; Kinder Finimal; Liquigesic Co; Mono Praecimed; Percocet-Demi; Perdolan Mono; Rockamol Plus; Viclor Richet; Actifed Plus; Kratofin simplex; Neo-Fepramol; Paracetamol AL; Paracetamol BC; Paracetamol PB; Acetanilide, 4'-hydroxy-; Claradol Codeine; Geralgine-P; Melabon Infantil; Migraleve Yellow; Paracetamol Saar; Pyregesic-C; Anti-Algos; Para-Suppo; Pasolind N; Supramol-M; No-Febril; Panado-Co; Para-Tabs; Paracetamol Hexal; Paracetamol Raffo; Paracetamol Rosch; Paracetamol Stada; Dol-Stop; Anadin dla dzieci; p-Hydroxyphenolacetamide; Percocet-5; Cod-Acamol Forte; Contra-Schmerz P; Hy-Phen; Medinol Paediatric; Paracetamol Basics; Panado-Co Caplets; Paracetamol von ct; Pe-Tam; Paracetamol Fecofar; Paracetamol Harkley; Paracetamol Heumann; Paracetamol Nycomed; Codral Pain Relief; Paracetamol Hanseler; Paracetamol Winthrop; 4-Hydroxyacetanilide; Phenaphen W/Codeine; Spalt fur die nacht; A.F. Anacin; Capital with Codeine; Paracetamol Genericon; Anexsia; Demilets; Efferalgan; Endecon; Intensin; Naldegesic; Propacet; Resfenol; Theraflu; Wygesic; Paracetamol Ratiopharm; Coricidin Sinus; Paracetamol Italfarmaco; Sudafed Sinus; Coricidin D; Paracetamol DC; Quiet World; Paracetamol Antipanin P; St Joseph Aspirin-Free; New Cortal for Children; INFANTS' FEVERALL; St. Joseph Fever Reducer; Midol Teen Formula; Paracetamol Dr. Schmidgall; Acetamide, N-(p-hydroxyphenyl)-; p-hydroxy-acetanilid; Aspirin-Free Anacin; Children's Tylenol Chewable; NCI-C55801; PCM Paracetamol Lichtenstein; Tylenol Allergy Sinus; p-(Acetylamino)phenol; Rhinex D-Lay Tablets; acetaminophene; Midol Regular Strength; Paracetamol SmithKline Beecham; Scherzatabletten Rezeptur 534; Percogesic with Codeine; 4-Hydroxyanilid kyseliny octove; Bayer Select Head Cold; Bayer Select Allergy-Sinus; Bayer Select Headache Pain; Dristan Cold No Drowsiness; Prestwick_13; St Joseph Aspirin-Free for Children; 4-acetylaminophenol; Children's Acetaminophen Elixir Drops; MFCD00002328; Midol PM Night Time Formula; Triaminic Sore Throat Formula; N-(4-hydroxyphenyl)ethanamide; Bayer Select Sinus Pain Relief; Phenol, p-acetamido-; Sine-Off Sinus Medicine Caplets; CHEBI:46195; Roxicet 5/500; Tocris-1706; NSC-3991; N-acetyl-para-aminophenol; 4-(N-Acetylamino)phenol; Acetaminophen (4-hydroxyacetanilide); Bayer Select Menstrual Multi-Symptom; Acetaco; n-acetyl-4-hydroxyaniline; St. Joseph Cold Tablets for Children; CHEMBL112; NSC-109028; N-(4-Hydroxyphenyl)acetamide (Tylenol); N-(4-hydroxyphenyl)-acetamide; 362O9ITL9D; Aminofen; DTXSID2020006; Atasol; Duaneo; Duorol; component of Dialog; component of Dilone; Fever All; Paracetamol (INN); component of Endecon; component of Percocet; component of Phenaphen; TYL; component of Percogesic; DSSTox_CID_6; NCGC00016361-07; Acetominophen; Actamin; CAS-103-90-2; Pasolind; Redutemp; Robigesic; Valorin; Aceta Elixir; PARACETAMOL [INN]; Dafalgan Codeine; Jin Gang; WLN: QR DMV1; DSSTox_RID_75318; DSSTox_GSID_20006; component of Hycomine Compound; Acetavance; Paracetamolo [Italian]; Calonal; Flexsure; Acenol (pharmaceutical); N-(4-Hydroxyphenyl)acetanilide; Drixoral Sinus; Aceta Tablets; Paracetamol [INN:BAN]; Valorin Extra; CCRIS 3; Snaplets-FR; Oraphen-PD; Phenaphen Caplets; Paracetamolum [INN-Latin]; Tylenol (caplet); Tylenol (geltab); Tylenol 8-Hour; SMR000112065; Tavist Allergy/Sinus/Headache; Dapa X-S; Drixoral Cold & Flu; HSDB 3001; SR-01000597517; EINECS 203-157-5; 222 AF; Acetaminophen [USP:JAN]; paracetamol (acetaminophen); NSC 109028; acetominophene; UNII-362O9ITL9D; 4-Hydroxyanilid kyseliny octove [Czech]; Claratal; Daphalgan; Resprin; Apacet Capsules; Atasol Caplets; Atasol Tablets; Tempra Caplets; Tylenol Caplets; Tylenol Elixir; Tylenol Gelcaps; Tylenol Tablets; Actamin Extra; Actamin Super; Aminofen Max; ANEXSIA 10/660; Apacet Elixir; Atasol Drops; Exdol Strong; p-Acetoaminophen; Tempra Drops; Tylenol Drops; alpha-Per; Citramon P; Excedrin Caplets; Dial-alpha-gesic; Apo-Acetaminophen; 4-acetominophenol; Genebs X-Tra; Paracetamol;Tylenol; 4-acetamido phenol; 4-acetamido-phenol; Tempra D.S; APAP, Paracetamol; p-hydroxyacetoanilide; Tylenol (TN); Supac (Salt/Mix); Tylox (Salt/Mix); Zydone (Salt/Mix); Atasol Forte Caplets; Atasol Forte Tablets; para-acetylaminophenol; Anexsia (Salt/Mix); Endecon (Salt/Mix); Sinubid (Salt/Mix); Talacen (Salt/Mix); Vicodin (Salt/Mix); Wygesic (Salt/Mix); Acetaminophen Uniserts; Datril Extra-Strength; Tylenol Infants Drops; Demilets (Salt/Mix); Empracet (Salt/Mix); Intensin (Salt/Mix); Propacet (Salt/Mix); Suppap-120; Suppap-325; Suppap-650; Panadol Extra Strength; TheraFlu (Salt/Mix); Coricidin (Salt/Mix); Liquiprin (Salt/Mix); Hy-Phen (Salt/Mix); IV-APAP; phenol derivative, 11; Spectrum_000016; Tempra Chewable Tablets; Naldegesic (Salt/Mix); Actimol Chewable Tablets; Feverall Junior Strength; Darvocet-N (Salt/Mix); Anacin-3 Extra Strength; Liquiprin Infants" Drops; N-acetyl para aminophenol; Prestwick0_000868; Prestwick1_000868; Prestwick2_000868; Prestwick3_000868; Spectrum2_000085; Spectrum3_000283; Spectrum4_000140; Spectrum5_000736; Coricidin D (Salt/Mix); Quiet World (Salt/Mix); Genapap Children's Elixir; Tylenol Children's Elixir; 4-Acetamidophenol, 98%; Actifed Plus (Salt/Mix); ACETAMINOPHEN [MI]; PARACETAMOL [IARC]; Epitope ID:117710; Genapap Children's Tablets; Sudafed Sinus (Salt/Mix); ACETAMINOPHEN [JAN]; EC 203-157-5; Actimol Infants' Suspension; Drixoral Sinus (Salt/Mix); Liquiprin Children's Elixir; SCHEMBL3480; Acetaminophen (JP17/USP); ACETAMINOPHEN [HSDB]; ACETAMINOPHEN [INCI]; Coricidin Sinus (Salt/Mix); N-(4-hydroxyfenyl)ethanamid; PARACETAMOL [MART.]; ACETAMINOPHEN [VANDF]; BSPBio_000915; BSPBio_001786; DDS-06A; KBioGR_000560; KBioSS_000356; PARACETAMOL [WHO-DD]; PARACETAMOL [WHO-IP]; 4-13-00-01091 (Beilstein Handbook Reference); Actimol Children's Suspension; Apacet Extra Strength Caplets; Apacet Extra Strength Tablets; Aspirin-Free Excedrin Caplets; Genebs Extra Strength Caplets; MLS001146925; MLS001331684; MLS002154041; BIDD:GT0005; DivK1c_000660; SPECTRUM1500101; Genapap Extra Strength Caplets; Genapap Extra Strength Tablets; SPBio_000010; SPBio_002836; Tapanol Extra Strength Caplets; Tapanol Extra Strength Tablets; Tylenol Extra Strength Caplets; Tylenol Extra Strength Gelcaps; Tylenol Extra Strength Tablets; ACETAMINOPHEN [USP-RS]; Actimol Junior Strength Caplets; Apacet Regular Strength Tablets; BPBio1_001007; Excedrin Extra Strength Caplets; Genebs Regular Strength Tablets; GTPL5239; Panadol Junior Strength Caplets; SGCUT00014; Tylenol Junior Strength Caplets; Midol Teen Formula (Salt/Mix); Genapap Regular Strength Tablets; Panadol Maximum Strength Caplets; Panadol Maximum Strength Tablets; SCHEMBL19474893; Tylenol Regular Strength Caplets; Tylenol Regular Strength Tablets; Aspirin-Free Anacin (Salt/Mix); BDBM26197; HMS502A22; KBio1_000660; KBio2_000356; KBio2_002924; KBio2_005492; KBio3_001286; NSC3991; Tylenol Arthritis Extended Relief; Acetaminophen, analytical standard; NINDS_000660; Tylenol Infants" Suspension Drops; BCPP000441; Drixoral Cold & Flu (Salt/Mix); HMS1570N17; HMS1920A03; HMS2091G03; HMS2097N17; HMS2269G20; HMS3268A10; HMS3412D16; HMS3676D16; HMS3714N17; PARACETAMOL [EP MONOGRAPH]; Pharmakon1600-01500101; Tylenol Allergy Sinus (Salt/Mix); ACETAMINOPHEN [ORANGE BOOK]; Midol Regular Strength (Salt/Mix); ACT06727; ALLAY COMPONENT ACETAMINOPHEN; AMY39958; BCP23431; BUCET COMPONENT ACETAMINOPHEN; ESGIC COMPONENT ACETAMINOPHEN; NORCO COMPONENT ACETAMINOPHEN; NSC 3991; STR00901; to_000023; TRIAD COMPONENT ACETAMINOPHEN; Tylenol Children's Chewable Tablets; TYLOX COMPONENT ACETAMINOPHEN; ACETAMINOPHEN [USP IMPURITY]; Acetaminophen, BioXtra, >=99.0%; Bayer Select Head Cold (Salt/Mix); Robitussin Night Relief (Salt/Mix); Tox21_110397; Tox21_201930; Tox21_300100; AC8790; ACETAMINOPHEN [USP MONOGRAPH]; BANCAP COMPONENT ACETAMINOPHEN; BBL005229; CCG-38901; CODRIX COMPONENT ACETAMINOPHEN; FEMCET COMPONENT ACETAMINOPHEN; LORTAB COMPONENT ACETAMINOPHEN; NORCET COMPONENT ACETAMINOPHEN; NSC109028; NSC755853; OXYCET COMPONENT ACETAMINOPHEN; PARACETAMOLUM [WHO-IP LATIN]; STL140694; TENCON COMPONENT ACETAMINOPHEN; TREZIX COMPONENT ACETAMINOPHEN; Tylenol Children's Suspension Liquid; ZINC13550868; ZYDONE COMPONENT ACETAMINOPHEN; ANEXSIA COMPONENT ACETAMINOPHEN; ANOQUAN COMPONENT ACETAMINOPHEN; BUTAPAP COMPONENT ACETAMINOPHEN; ROXICET COMPONENT ACETAMINOPHEN; ROXILOX COMPONENT ACETAMINOPHEN; SEDAPAP COMPONENT ACETAMINOPHEN; TALACEN COMPONENT ACETAMINOPHEN; TYCOLET COMPONENT ACETAMINOPHEN; VICODIN COMPONENT ACETAMINOPHEN; WYGESIC COMPONENT ACETAMINOPHEN; AKOS000121004; DARVOCET COMPONENT ACETAMINOPHEN; EXCEDRIN COMPONENT ACETAMINOPHEN; Feverall Sprinkle Caps Junior Strength; FIORICET COMPONENT ACETAMINOPHEN; HY-PHEN COMPONENT ACETAMINOPHEN; Ornex Severe Cold Formula (Salt/Mix); PERCOCET COMPONENT ACETAMINOPHEN; Tox21_110397_1; TRIAPRIN COMPONENT ACETAMINOPHEN; ULTRACET COMPONENT ACETAMINOPHEN; XARTEMIS COMPONENT ACETAMINOPHEN; ACETAMINOPHEN COMPONENT OF ALLAY; ACETAMINOPHEN COMPONENT OF BUCET; ACETAMINOPHEN COMPONENT OF ESGIC; ACETAMINOPHEN COMPONENT OF NORCO; ACETAMINOPHEN COMPONENT OF TRIAD; ACETAMINOPHEN COMPONENT OF TYLOX; Bayer Select Allergy-Sinus (Salt/Mix); BCP9000225; CO-GESIC COMPONENT ACETAMINOPHEN; DB00316; DHC PLUS COMPONENT ACETAMINOPHEN; NSC-755853; ACETAMINOPHEN COMPONENT OF BANCAP; ACETAMINOPHEN COMPONENT OF CODRIX; ACETAMINOPHEN COMPONENT OF FEMCET; ACETAMINOPHEN COMPONENT OF LORTAB; ACETAMINOPHEN COMPONENT OF NORCET; ACETAMINOPHEN COMPONENT OF OXYCET; ACETAMINOPHEN COMPONENT OF TENCON; ACETAMINOPHEN COMPONENT OF ZYDONE; BANCAP HC COMPONENT ACETAMINOPHEN; IDI1_000660; LORCET-HD COMPONENT ACETAMINOPHEN; PHRENILIN COMPONENT ACETAMINOPHEN; Sine-Aid, Maximum Strength (Salt/Mix); Sudafed Severe Cold Formula (Salt/Mix); ACETAMINOPHEN COMPONENT OF ANEXSIA; ACETAMINOPHEN COMPONENT OF ANOQUAN; ACETAMINOPHEN COMPONENT OF BUTAPAP; ACETAMINOPHEN COMPONENT OF ROXICET; ACETAMINOPHEN COMPONENT OF ROXILOX; ACETAMINOPHEN COMPONENT OF SEDAPAP; ACETAMINOPHEN COMPONENT OF TALACEN; ACETAMINOPHEN COMPONENT OF TYCOLET; ACETAMINOPHEN COMPONENT OF VICODIN; ACETAMINOPHEN COMPONENT OF WYGESIC; NCGC00016361-01; NCGC00016361-02; NCGC00016361-03; NCGC00016361-04; NCGC00016361-05; NCGC00016361-06; NCGC00016361-08; NCGC00016361-09; NCGC00016361-10; NCGC00016361-12; NCGC00016361-13; NCGC00016361-20; NCGC00025267-01; NCGC00025267-02; NCGC00025267-03; NCGC00025267-04; NCGC00025267-05; NCGC00253912-01; NCGC00259479-01; Tylenol Junior Strength Chewable Tablets; 8055-08-1; AC-23969; ACETAMINOPHEN COMPONENT OF DARVOCET; ACETAMINOPHEN COMPONENT OF EXCEDRIN; ACETAMINOPHEN COMPONENT OF FIORICET; ACETAMINOPHEN COMPONENT OF HY-PHEN; ACETAMINOPHEN COMPONENT OF PERCOCET; ACETAMINOPHEN COMPONENT OF TRIAPRIN; ACETAMINOPHEN COMPONENT OF ULTRACET; ACETAMINOPHEN COMPONENT OF XARTEMIS; HY-66005; Midol PM Night Time Formula (Salt/Mix); SY001162; Triaminic Sore Throat Formula (Salt/Mix); ACETAMINOPHEN COMPONENT OF CO-GESIC; ACETAMINOPHEN COMPONENT OF DHC PLUS; ACETAMINOPHEN COMPONENT OF PHRENILIN; BCP0726000305; DURADYNE DHC COMPONENT ACETAMINOPHEN; SBI-0051269.P003; ACETAMINOPHEN COMPONENT OF BANCAP HC; ACETAMINOPHEN COMPONENT OF LORCET-HD; Bayer Select Sinus Pain Relief (Salt/Mix); DRIXORAL PLUS COMPONENT ACETAMINOPHEN; AB00051905; Aspirin Free Anacin Maximum Strength Caplets; Aspirin Free Anacin Maximum Strength Tablets; DOLENE AP-65 COMPONENT ACETAMINOPHEN; FT-0658035; FT-0661041; FT-0661042; H0190; MEDIGESIC PLUS COMPONENT ACETAMINOPHEN; Sine-Off Sinus Medicine Caplets (Salt/Mix); SYNALGOS-DC-A COMPONENT ACETAMINOPHEN; ACETAMINOPHEN COMPONENT OF DURADYNE DHC; EN300-17510; N-(4-Hydroxyphenyl)-acetamide-[13C2,15N]; ACETAMINOPHEN COMPONENT OF DOLENE AP-65; ACETAMINOPHEN COMPONENT OF DRIXORAL PLUS; ACETAMINOPHEN COMPONENT OF SYNALGOS-DC-A; C06804; D00217; Q57055; AB00051905-09; AB00051905_10; ACETAMINOPHEN COMPONENT OF MEDIGESIC PLUS; Aspirin Free Anacin Maximum Strength Gel Caplets; Bayer Select Menstrual Multi-Symptom (Salt/Mix); Contac Cough & Sore Throat Formula (Salt/Mix); L024125; St. Joseph Cold Tablets for Children (Salt/Mix); Tylenol Extra Strength Adult Liquid Pain Reliever; J-001064; J-514275; Paracetamol (Acetaminophen) 1.0 mg/ml in Methanol; SR-01000597517-1; SR-01000597517-2; SR-01000597517-4; Acetaminophenol 4-Acetamino phenol Paracetamol Somedon; BRD-K41524689-001-08-6; Z56946051; F3096-1731; F48B493F-B1FD-410C-AA0A-F40EC71A0689; Bayer Select Maximum Strength Headache Pain Relief Formula; Paracetamol, British Pharmacopoeia (BP) Reference Standard; Paracetamol, European Pharmacopoeia (EP) Reference Standard; Acetaminophen, United States Pharmacopeia (USP) Reference Standard; Acetaminophen, meets USP testing specifications, 98.0-102.0%, powder; Acetaminophen, Pharmaceutical Secondary Standard; Certified Reference Material; Paracetamol for equipment qualification, EuropePharmacopoeia (EP) Reference Standard
CAS 103-90-2
PubChem CID 1983
ChEMBL ID CHEMBL112
*Note: the IUPAC Name was collected from PubChem.
Chemical Classification:
  • Kingdom: Organic compounds
    • Superclass: Benzenoids
      • Class: Benzene and substituted d
        • Subclass: Anilides
          • Direct Parent: Acetanilides

ClassyFire Version 1.0
PMID:27867422

NPs Species Source

Endophyte ID Endophyte Name Family Genus Taxonomy ID GenBank ID Closest GenBank ID Reference
Endophyte ID Endophyte Name Family Genus Taxonomy ID GenBank ID Closest GenBank ID Reference

NPs Content

*Note: The vaules in Content Percentage are calculated by dividing the content value by the maximum content value in NP Content.
**Note: The units with different NP content, due to their incomparable values, are separated into different tables.

NPs Biological Activity

Bioactivity Name Target ID Target Name Target Type Target Organism Target Organism ID Potency of Bioactivity Activity Type Value Unit Endophyte ID Endophyte Name
Bioactivity Name Target ID Target Name Target Type Target Organism Target Organism ID Potency of Bioactivity Activity Type Value Unit Endophyte ID Endophyte Name

NPs Physi-Chem Properties

Molecular Weight: 151.16 ALogp: 0.5
HBD: 2 HBA: 2
Rotatable Bonds: 1 Lipinski's rule of five: Accepted
Polar Surface Area: 49.3 Aromatic Rings: 1
Heavy Atoms: 11 QED Weighted: 0.602

NPs ADMET Properties*

ADMET: Absorption

Caco-2 Permeability: -4.482 MDCK Permeability: 0.00000914
Pgp-inhibitor: 0 Pgp-substrate: 0.461
Human Intestinal Absorption (HIA): 0.009 20% Bioavailability (F20%): 0.019
30% Bioavailability (F30%): 0.641

ADMET: Distribution

Blood-Brain-Barrier Penetration (BBB): 0.83 Plasma Protein Binding (PPB): 14.86%
Volume Distribution (VD): 0.923 Fu: 70.54%

ADMET: Metabolism

CYP1A2-inhibitor: 0.29 CYP1A2-substrate: 0.72
CYP2C19-inhibitor: 0.103 CYP2C19-substrate: 0.26
CYP2C9-inhibitor: 0.024 CYP2C9-substrate: 0.856
CYP2D6-inhibitor: 0.039 CYP2D6-substrate: 0.67
CYP3A4-inhibitor: 0.037 CYP3A4-substrate: 0.373

ADMET: Excretion

Clearance (CL): 8.547 Half-life (T1/2): 0.907

ADMET: Toxicity

hERG Blockers: 0.02 Human Hepatotoxicity (H-HT): 0.18
Drug-inuced Liver Injury (DILI): 0.385 AMES Toxicity: 0.321
Rat Oral Acute Toxicity: 0.043 Maximum Recommended Daily Dose: 0.059
Skin Sensitization: 0.593 Carcinogencity: 0.624
Eye Corrosion: 0.031 Eye Irritation: 0.838
Respiratory Toxicity: 0.039
*Note: the ADMET properties was calculated by ADMETlab 2.0. Reference: PMID: 33893803.

Similar Compounds*

Compounds similar to EMNPD with top10 similarity:

Similar NPs Similar Drugs
NPs ID NPs 2D Structure Similarity Score TTD ID Drug 2D Structure Similarity Score
ENC000200 0.583 D0U5QK 1.000
ENC000106 0.571 D02AQY 0.581
ENC000870 0.535 D03UOT 0.444
ENC000007 0.500 D0KD1U 0.439
ENC000195 0.500 D0B3QM 0.426
ENC000665 0.500 D02WAB 0.426
ENC000086 0.486 D01CRB 0.413
ENC001422 0.467 D0W1RY 0.386
ENC004860 0.465 D07QFP 0.379
ENC000370 0.463 D08GJO 0.343
*Note: the compound similarity was calculated by RDKIT.