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CHEBI:69179 - sandaracopimaradiene-1alpha,9alpha-diol

ChEBI IDCHEBI:69179
ChEBI Namesandaracopimaradiene-1alpha,9alpha-diol
Stars
DefinitionA natural product found in Trigonostemon heterophyllus.
Last Modified20 May 2016
DownloadsMolfile
FormulaC20H32O2
Net Charge0
Average Mass304.474
Monoisotopic Mass304.24023
SMILES[H][C@@]12CCC3=C[C@@](C)(C=C)CC[C@]3(O)[C@@]1(C)[C@@H](O)CCC2(C)C
InChIInChI=1S/C20H32O2/c1-6-18(4)11-12-20(22)14(13-18)7-8-15-17(2,3)10-9-16(21)19(15,20)5/h6,13,15-16,21-22H,1,7-12H2,2-5H3/t15-,16-,18-,19+,20+/m0/s1
InChIKeyNSRIQLOVXVWUAB-FLFBIERCSA-N
Species of MetaboliteComponentSourceComments
Trigonostemon heterophyllus (IPNI:358015-1) twig (BTO:0001411) PubMed (22122667) 95% EtOH extract of powdered and air-dried twigs
Roles Classification
Biological Role:
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)
sandaracopimaradiene-1alpha,9alpha-diol (CHEBI:69179) has role metabolite (CHEBI:25212)
sandaracopimaradiene-1alpha,9alpha-diol (CHEBI:69179) is a diol (CHEBI:23824)
sandaracopimaradiene-1alpha,9alpha-diol (CHEBI:69179) is a tricyclic diterpenoid (CHEBI:79084)
Citations