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CHEBI:69224 - 3α-hydroxyolean-11-en-28,13β-olide

ChEBI IDCHEBI:69224
ChEBI Name3α-hydroxyolean-11-en-28,13β-olide
Stars
ASCII Name3alpha-hydroxyolean-11-en-28,13beta-olide
DefinitionA terpene lactone that is 13,28-epoxyolean-11-en-28-one substituted by an α-hydroxy group at position 3. It has been isolated from the leaves and twigs of Fatsia polycarpa.
Last Modified2 December 2013
DownloadsMolfile
FormulaC30H46O3
Net Charge0
Average Mass454.695
Monoisotopic Mass454.34470
SMILES[H][C@]12C=C[C@]34OC(=O)[C@@]5(CCC(C)(C)C[C@]53[H])CC[C@@]4(C)[C@]1(C)CC[C@@]1([H])C(C)(C)[C@H](O)CC[C@]21C
InChIInChI=1S/C30H46O3/c1-24(2)14-16-29-17-15-28(7)27(6)12-8-19-25(3,4)22(31)10-11-26(19,5)20(27)9-13-30(28,21(29)18-24)33-23(29)32/h9,13,19-22,31H,8,10-12,14-18H2,1-7H3/t19-,20+,21+,22+,26-,27+,28-,29-,30-/m0/s1
InChIKeyVQUPEZXRIUOIJE-XDPQSBAJSA-N
Species of MetaboliteComponentSourceComments
Fatsia polycarpa (ncbitaxon:230586)
twig (BTO:0001411) PubMed (21766884) Methylene dichloride soluble fraction of MeOH extract of air-dried and powdered leaves and twigs
leaf (BTO:0000713) PubMed (21766884) Methylene dichloride soluble fraction of MeOH extract of air-dried and powdered leaves and twigs
Roles Classification
Biological Roles:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
3α-hydroxyolean-11-en-28,13β-olide (CHEBI:69224) has parent hydride oleanane (CHEBI:36481)
3α-hydroxyolean-11-en-28,13β-olide (CHEBI:69224) has role metabolite (CHEBI:25212)
3α-hydroxyolean-11-en-28,13β-olide (CHEBI:69224) has role plant metabolite (CHEBI:76924)
3α-hydroxyolean-11-en-28,13β-olide (CHEBI:69224) is a hexacyclic triterpenoid (CHEBI:70994)
3α-hydroxyolean-11-en-28,13β-olide (CHEBI:69224) is a secondary alcohol (CHEBI:35681)
3α-hydroxyolean-11-en-28,13β-olide (CHEBI:69224) is a terpene lactone (CHEBI:37668)
IUPAC Name 
(3α)-3-hydroxy-13,28-epoxyolean-11-en-28-one
Registry NumbersSources
Reaxys:8739334Reaxys
Citations