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CHEBI:230011 - 6beta-Hydroxy-3-oxo-12-oleanen-28-oic acid

Default Structure
ChEBI IDCHEBI:230011
ChEBI Name6beta-Hydroxy-3-oxo-12-oleanen-28-oic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H46O4
Net Charge0
Average Mass470.694
Monoisotopic Mass470.33961
SMILESCC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(=O)C(C)(C)C5C(O)CC43C)C2C1
InChIInChI=1S/C30H46O4/c1-25(2)12-14-30(24(33)34)15-13-28(6)18(19(30)16-25)8-9-21-27(5)11-10-22(32)26(3,4)23(27)20(31)17-29(21,28)7/h8,19-21,23,31H,9-17H2,1-7H3,(H,33,34)
InChIKeyGBMBQYFNPMVAMS-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS9087)
ChEBI Ontology
Outgoing Relation(s)
6beta-Hydroxy-3-oxo-12-oleanen-28-oic acid (CHEBI:230011) is a triterpenoid (CHEBI:36615)
IUPAC Name 
8-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-10-oxo-3,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylic acid
Manual XrefsDatabases
35013727ChemSpider
HMDB0034508HMDB