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CHEBI:177118 - (3beta,23E)-3-Hydroxy-27-norcycloart-23-en-25-one

Default Structure
ChEBI IDCHEBI:177118
ChEBI Name(3beta,23E)-3-Hydroxy-27-norcycloart-23-en-25-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H46O2
Net Charge0
Average Mass426.685
Monoisotopic Mass426.34978
SMILESCC(=O)/C=C/CC(C)C1CCC2(C)C3CCC4C(C)(C)C(O)CCC45CC35CCC12C
InChIInChI=1S/C29H46O2/c1-19(8-7-9-20(2)30)21-12-14-27(6)23-11-10-22-25(3,4)24(31)13-15-28(22)18-29(23,28)17-16-26(21,27)5/h7,9,19,21-24,31H,8,10-18H2,1-6H3/b9-7+
InChIKeyWNTCMDLOMSFFPE-VQHVLOKHSA-N
Species of MetaboliteComponentSourceComments
Bos grunniens (ncbitaxon:30521) subcutaneous adipose tissue (BTO:0004042) Article
ChEBI Ontology
Outgoing Relation(s)
(3beta,23E)-3-Hydroxy-27-norcycloart-23-en-25-one (CHEBI:177118) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(E)-6-(6-hydroxy-7,7,12,16-tetramethyl-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl)hept-3-en-2-one
Manual XrefsDatabases
74886460ChemSpider
HMDB0037382HMDB