InCHi String:
InChI=1S/C10H9NO3/c12-7-1-2-9-8(4-7)6(5-11-9)3-10(13)14/h1-2,4-5,11-12H,3H2,(H,13,14)
canonical and isomeric SMILES: C1=CC2=C(C=C1O)C(=CN2)CC(=O)O
PUBCHEM iupac NAME: PUBCHEM iupac TRADITIONAL NAME: PUBCHEM iupac OPENEYE NAME: PUBCHEM iupac CAS NAME2-(5-hydroxy-1H-indol-3-yl)acetic acid
PUBCHEM iupac SYSTEMATIC NAME2-(5-hydroxy-1H-indol-3-yl)ethanoic acid
PubChem Substance (SID):
85165160 11448923 15042342PubChem Compound (CID):
1826KEGG: Compound ID
C05635CAS Registry IDs: 99155-61-0 54-16-0 1321-73-9 113303-91-6
PDB Chemical Component n/a
Miscellaneous Databases and IDs:
Sigma-Aldrich H8876_SIGMA
ChemBank NCIOpen2_001406
Emory University Molecular Libraries Screening Center EU-0100636
ChemIDplus 001321739
ChemSpider 1760
EINECS 200-195-4
CCRIS 4423
Beilstein Handbook Reference 5-22-05-00203
ChemDB 3965065
DTP/NCI 90432
Thomson Pharma 00508550
NIST Chemistry WebBook 3905704898
MMCD cq_03161
MDL MFCD00005639
Reference data were obtained primarily from the PubChem database.
Three dimensional molecular rendering uses Jmol.