EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:10274 - alpha-Elemolic acid

Default Structure
ChEBI IDCHEBI:10274
ChEBI Namealpha-Elemolic acid
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC30H48O3
Net Charge0
Average Mass456.711
Monoisotopic Mass456.36035
SMILES[H][C@@]1([C@]([H])(CCC=C(C)C)C(=O)O)CC[C@]2(C)C3=C(CC[C@@]12C)[C@@]1(C)CC[C@@H](O)C(C)(C)[C@]1([H])CC3
InChIInChI=1S/C30H48O3/c1-19(2)9-8-10-20(26(32)33)21-13-17-30(7)23-11-12-24-27(3,4)25(31)15-16-28(24,5)22(23)14-18-29(21,30)6/h9,20-21,24-25,31H,8,10-18H2,1-7H3,(H,32,33)/t20-,21-,24-,25+,28+,29-,30+/m0/s1
InChIKeyNBSBUIQBEPROBM-IMJUUJEHSA-N
ChEBI Ontology
Outgoing Relation(s)
alpha-Elemolic acid (CHEBI:10274) is a triterpenoid (CHEBI:36615)
Synonym  Source
alpha-Elemolic acidKEGG COMPOUND
Manual XrefsDatabases
C00003744KNApSAcK
C08623KEGG COMPOUND
HMDB0034964HMDB
Registry NumbersSources
CAS:28282-27-1KEGG COMPOUND