EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:62459 - 24-hydroxy-β-amyrin

ChEBI IDCHEBI:62459
ChEBI Name24-hydroxy-β-amyrin
Stars
ASCII Name24-hydroxy-beta-amyrin
DefinitionA pentacyclic triterpenoid that is oleanane which is substituted by hydroxy groups at the 3β and 24 positions, and which has a double bond between positions 12 and 13.
Last Modified22 October 2012
SubmitterGareth Owen
DownloadsMolfile
FormulaC30H50O2
Net Charge0
Average Mass442.728
Monoisotopic Mass442.38108
SMILES[H][C@]12CC=C3[C@]4([H])CC(C)(C)CC[C@]4(C)CC[C@@]3(C)[C@]1(C)CC[C@]1([H])[C@]2(C)CC[C@H](O)[C@]1(C)CO
InChIInChI=1S/C30H50O2/c1-25(2)14-15-26(3)16-17-29(6)20(21(26)18-25)8-9-23-27(4)12-11-24(32)28(5,19-31)22(27)10-13-30(23,29)7/h8,21-24,31-32H,9-19H2,1-7H3/t21-,22+,23+,24-,26+,27-,28+,29+,30+/m0/s1
InChIKeyNTWLPZMPTFQYQI-FLZFTVBESA-N
ChEBI Ontology
Outgoing Relation(s)
24-hydroxy-β-amyrin (CHEBI:62459) has functional parent β-amyrin (CHEBI:10352)
24-hydroxy-β-amyrin (CHEBI:62459) has parent hydride oleanane (CHEBI:36481)
24-hydroxy-β-amyrin (CHEBI:62459) is a pentacyclic triterpenoid (CHEBI:25872)
IUPAC Name 
olean-12-ene-3β,24-diol
Synonyms  Source
(3β)-olean-12-ene-3,24-diolIUPAC
3β,24-dihydroxyolean-12-eneChEBI
UniProt Name  Source
24-hydroxy-β-amyrinUniProt
Manual XrefsDatabases
CPD-7608MetaCyc
Registry NumbersSources
Reaxys:3222507Reaxys
Citations