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CHEBI:140275 - 2α,3α-dihydroxy-ent-isokaurene

ChEBI IDCHEBI:140275
ChEBI Name2α,3α-dihydroxy-ent-isokaurene
Stars
ASCII Name2alpha,3alpha-dihydroxy-ent-isokaurene
DefinitionAn ent-kaurane diterpenoid in which the ent-kaurane skeleton has a double bond at C-15 and carries two α-configured hydroxy groups at C-2 and C-3.
Last Modified2 March 2018
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC20H32O2
Net Charge0
Average Mass304.474
Monoisotopic Mass304.24023
SMILES[H][C@@]12CC[C@@H]3C[C@]1(C=C3C)CC[C@]1([H])C(C)(C)[C@H](O)[C@H](O)C[C@@]21C
InChIInChI=1S/C20H32O2/c1-12-9-20-8-7-15-18(2,3)17(22)14(21)11-19(15,4)16(20)6-5-13(12)10-20/h9,13-17,21-22H,5-8,10-11H2,1-4H3/t13-,14-,15-,16+,17-,19-,20-/m1/s1
InChIKeyWNDMUTXXXQEUPV-VWZCVCQNSA-N
Species of MetaboliteComponentSourceComments
Oryza sativa (ncbitaxon:4530) - PubMed (21985968)
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
2α,3α-dihydroxy-ent-isokaurene (CHEBI:140275) has role plant metabolite (CHEBI:76924)
2α,3α-dihydroxy-ent-isokaurene (CHEBI:140275) is a ent-kaurane diterpenoid (CHEBI:36760)
UniProt Name  Source
ent-isokaurene-2β,3β-diolUniProt
Manual XrefsDatabases
CPD-20322MetaCyc
Citations