1D-1-O-(indol-3-yl)acetyl-myo-inositol

Chemical Formula:

C₁₆H₁₉NO₇

Molecular Weight:

337.329 Daltons

Monoisotopic Mass:

337.1161519698 Daltons

SMILES:

C(OC1(C(O)C(O)C(O)C(O)C(O)1))(=O)CC2(=CNC3(C=CC=CC2=3))

InChI:

1S/C16H19NO7/c18-10(5-7-6-17-9-4-2-1-3-8(7)9)24-16-14(22)12(20)11(19)13(21)15(16)23/h1-4,6,11-17,19-23H,5H2/t11-,12-,13+,14-,15-,16-/m1/s1

InChIKey:

XUACNUJFOIKYPQ-BKQXGZDCSA-N

Databases

MetaCyc: CPD-165

MetaboLights: MTBLC15711

HMDB: HMDB31182

ChemSpider: 389147

PubChem (CID): 440152

ChEBI: 15711

KEGG: C03868

MetaNetX: MNXM1379