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CHEBI:69956 - (1R,2E,4R,7E,11S,12R)-18-hydroxy-2,7-dolabelladiene

ChEBI IDCHEBI:69956
ChEBI Name(1R,2E,4R,7E,11S,12R)-18-hydroxy-2,7-dolabelladiene
Stars
DefinitionA natural product found in Dilophus spiralis.
Last Modified22 September 2014
DownloadsMolfile
FormulaC20H34O
Net Charge0
Average Mass290.491
Monoisotopic Mass290.26097
SMILES[H][C@@]12CC/C(C)=C/CC[C@@H](C)/C=C/[C@@]1(C)CC[C@H]2C(C)(C)O
InChIInChI=1S/C20H34O/c1-15-7-6-8-16(2)11-13-20(5)14-12-17(19(3,4)21)18(20)10-9-15/h7,11,13,16-18,21H,6,8-10,12,14H2,1-5H3/b13-11+,15-7+/t16-,17-,18+,20+/m1/s1
InChIKeyDPKKEAURYKNYJG-CUDBNEOOSA-N
Species of MetaboliteComponentSourceComments
Dilophus spiralis (ncbitaxon:499621) - PubMed (21190330) Dichloromethane and methanol extract of freeze-dried alga
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)
(1R,2E,4R,7E,11S,12R)-18-hydroxy-2,7-dolabelladiene (CHEBI:69956) has role metabolite (CHEBI:25212)
(1R,2E,4R,7E,11S,12R)-18-hydroxy-2,7-dolabelladiene (CHEBI:69956) is a diterpenoid (CHEBI:23849)
Synonym  Source
2-[(1R,3aR,4E,6R,12aS)-3a,6,10-Trimethyl-1,2,3,3a,6,7,8,11,12,12a-decahydrocyclopenta[11]annulen-1-yl]-2-propanolChEBI
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26393339ChemSpider
Citations