4-(indol-3-yl)butanoyl-β-D-glucose

Chemical Formula:

C₁₈H₂₃NO₇

Molecular Weight:

365.382 Daltons

Monoisotopic Mass:

365.1474520982 Daltons

SMILES:

C(O)C3(OC(OC(=O)CCCC1(C2(=C(NC=1)C=CC=C2)))C(O)C(O)C(O)3)

InChI:

1S/C18H23NO7/c20-9-13-15(22)16(23)17(24)18(25-13)26-14(21)7-3-4-10-8-19-12-6-2-1-5-11(10)12/h1-2,5-6,8,13,15-20,22-24H,3-4,7,9H2/t13-,15-,16+,17-,18+/m1/s1

InChIKey:

CIJFFKOICMQHCH-LHKMKVQPSA-N

Synonyms

IBA-glucose
indolebutyryl-glucose
indole-3-butyryl-D-glucose
IBA-Glc
indole-3-butyric acid D-glucoside
indole-3-butyryl-glucose

Databases

MetaCyc: CPD-12621

PubChem (CID): 91820526

ChEBI: 145927

MetaNetX: MNXM18665