ursolate

Chemical Formula:

C₃₀H₄₇O₃

Molecular Weight:

455.699 Daltons

Monoisotopic Mass:

455.699 Daltons

InChI:

1S/C30H48O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h8,18-19,21-24,31H,9-17H2,1-7H3,(H,32,33)/p-1/t18-,19+,21+,22-,23+,24+,27+,28-,29-,30+/m1/s1

InChIKey:

WCGUUGGRBIKTOS-GPOJBZKASA-M

Synonyms

ursolic acid
prunol
malol
urson
3β-hydroxyurs-12-en-28-oic acid
β-ursolic acid

Databases

PubChem (CID): 7163175

Seed: cpd05884

MetaNetX: MNXM88617

MetaboLights: MTBLC9908

HMDB: HMDB02395

ChEBI: 9908

KNApSAcK: C00003558

KEGG: C08988

MetaCyc: CPD-14496