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CHEBI:78256 - oryzalexin D

ChEBI IDCHEBI:78256
ChEBI Nameoryzalexin D
Stars
DefinitionA tricyclic diterpenoid that is ent-sandaracopimaradiene bearing two additional hydroxy substituents at the 3α- and 7β-positions.
Last Modified8 July 2014
SubmitterKAX
DownloadsMolfile
FormulaC20H32O2
Net Charge0
Average Mass304.474
Monoisotopic Mass304.24023
SMILES[H][C@@]12CC[C@@](C)(C=C)C=C1[C@@H](O)C[C@]1([H])C(C)(C)[C@H](O)CC[C@@]21C
InChIInChI=1S/C20H32O2/c1-6-19(4)9-7-14-13(12-19)15(21)11-16-18(2,3)17(22)8-10-20(14,16)5/h6,12,14-17,21-22H,1,7-11H2,2-5H3/t14-,15+,16-,17-,19-,20+/m1/s1
InChIKeyHRWWBCRSPUEXDM-XTMWUNHTSA-N
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)
oryzalexin D (CHEBI:78256) has role plant metabolite (CHEBI:76924)
oryzalexin D (CHEBI:78256) is a tricyclic diterpenoid (CHEBI:79084)
IUPAC Name 
(3α,5β,7β,9β,10α)-pimara-8(14),15-diene-3,7-diol
Synonyms  Source
ent-sandaracopimaradien-3α,7β-diolSUBMITTER
3α,7β-dihydroxy-ent-sandaracopimaradieneChEBI
UniProt Name  Source
oryzalexin DUniProt
Manual XrefsDatabases
CPD-16612MetaCyc
Registry NumbersSources
Reaxys:7000509Reaxys
CAS:110268-98-9ChemIDplus
Citations