CHEBI:175775 - 3b,18b-3-Methoxy-11-oxo-12-oleanen-30-oic acid

ChEBI IDCHEBI:175775
ChEBI Name3b,18b-3-Methoxy-11-oxo-12-oleanen-30-oic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC31H48O4
Net Charge0
Average Mass484.721
Monoisotopic Mass484.35526
SMILESCOC(=O)C1(C)CCC2(C)CCC3(C)C(=CC(=O)C4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1
InChIInChI=1S/C31H48O4/c1-26(2)22-9-12-31(7)24(29(22,5)11-10-23(26)33)21(32)17-19-20-18-28(4,25(34)35-8)14-13-27(20,3)15-16-30(19,31)6/h17,20,22-24,33H,9-16,18H2,1-8H3
InChIKeyRMIVRCBSQPCSCQ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3b,18b-3-Methoxy-11-oxo-12-oleanen-30-oic acid (CHEBI:175775) is a triterpenoid (CHEBI:36615)
IUPAC Name 
methyl 10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1H-picene-2-carboxylate
Manual XrefsDatabases
546307ChemSpider
HMDB0034516HMDB