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CHEBI:211801 - (7S,8S,12E)-8,17-Epoxy-7-Hydroxylabda-12,14-diene

ChEBI IDCHEBI:211801
ChEBI Name(7S,8S,12E)-8,17-Epoxy-7-Hydroxylabda-12,14-diene
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H32O2
Net Charge0
Average Mass304.474
Monoisotopic Mass304.24023
SMILESC=C/C(C)=C/C[C@@H]1[C@@]2(C)CCCC(C)(C)[C@@H]2C[C@H](O)[C@@]12CO2
InChIInChI=1S/C20H32O2/c1-6-14(2)8-9-15-19(5)11-7-10-18(3,4)16(19)12-17(21)20(15)13-22-20/h6,8,15-17,21H,1,7,9-13H2,2-5H3/b14-8+/t15-,16+,17+,19-,20-/m1/s1
InChIKeyVWQNLIAHGOKMCP-LZDKCEGCSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (26507838)
ChEBI Ontology
Outgoing Relation(s)
(7S,8S,12E)-8,17-Epoxy-7-Hydroxylabda-12,14-diene (CHEBI:211801) is a diterpenoid (CHEBI:23849)
IUPAC Name 
(2S,3S,4R,4aS,8aS)-4a,8,8-trimethyl-4-[(2E)-3-methylpenta-2,4-dienyl]spiro[2,4,5,6,7,8a-hexahydro-1H-naphthalene-3,2'-oxirane]-2-ol