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CHEBI:227437 - Acremeremophilane J

ChEBI IDCHEBI:227437
ChEBI NameAcremeremophilane J
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24O3
Net Charge0
Average Mass252.354
Monoisotopic Mass252.17254
SMILESC=C(CO)[C@@H]1C[C@@]2(C)C(=C[C@H](O)C[C@@H]2C)C[C@H]1O
InChIInChI=1S/C15H24O3/c1-9(8-16)13-7-15(3)10(2)4-12(17)5-11(15)6-14(13)18/h5,10,12-14,16-18H,1,4,6-8H2,2-3H3/t10-,12+,13-,14+,15+/m0/s1
InChIKeyDAVVJPQMLBOZPK-XFZHLKPQSA-N
Species of MetaboliteComponentSourceComments
Acremoniumspecies (ncbitaxon:2046025) - PubMed (26928174)
ChEBI Ontology
Outgoing Relation(s)
Acremeremophilane J (CHEBI:227437) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(2R,3S,4aR,5S,7R)-3-(3-hydroxyprop-1-en-2-yl)-4a,5-dimethyl-2,3,4,5,6,7-hexahydro-1H-naphthalene-2,7-diol
Manual XrefsDatabases
58196726ChemSpider