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CHEBI:187509 - 24-Methylcycloart-23-en-3beta-yl acetate

Default Structure
ChEBI IDCHEBI:187509
ChEBI Name24-Methylcycloart-23-en-3beta-yl acetate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC33H54O2
Net Charge0
Average Mass482.793
Monoisotopic Mass482.41238
SMILESCC(=O)OC1CCC23CC24CCC2(C)C(C(C)C/C=C(\C)C(C)C)CCC2(C)C4CCC3C1(C)C
InChIInChI=1S/C33H54O2/c1-21(2)22(3)10-11-23(4)25-14-16-31(9)27-13-12-26-29(6,7)28(35-24(5)34)15-17-32(26)20-33(27,32)19-18-30(25,31)8/h10,21,23,25-28H,11-20H2,1-9H3/b22-10+
InChIKeyBBSRNANRWHSVJE-LSHDLFTRSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
24-Methylcycloart-23-en-3beta-yl acetate (CHEBI:187509) is a triterpenoid (CHEBI:36615)
IUPAC Name 
[15-[(E)-5,6-dimethylhept-4-en-2-yl]-7,7,12,16-tetramethyl-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl] acetate
Manual XrefsDatabases
HMDB0035967HMDB