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CHEBI:227995 - (22E)-25-carboxy-8beta,14beta-epoxy-4alpha,5alpha-dihydroxyergosta-2,22-dien-7-one

ChEBI IDCHEBI:227995
ChEBI Name(22E)-25-carboxy-8beta,14beta-epoxy-4alpha,5alpha-dihydroxyergosta-2,22-dien-7-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H26O2
Net Charge0
Average Mass238.371
Monoisotopic Mass238.19328
SMILESC=C1CC[C@]2(O)[C@@H]([C@H]1O)[C@H](C(C)C)CC[C@H]2C
InChIInChI=1S/C15H26O2/c1-9(2)12-6-5-11(4)15(17)8-7-10(3)14(16)13(12)15/h9,11-14,16-17H,3,5-8H2,1-2,4H3/t11-,12+,13-,14+,15-/m1/s1
InChIKeyDQLZODFYAUOOHY-QKGCVVFFSA-N
Species of MetaboliteComponentSourceComments
Acremonium (ncbitaxon:159075) - DOI (10.1016/S1875-5364(17)30019-5)
ChEBI Ontology
Outgoing Relation(s)
(22E)-25-carboxy-8beta,14beta-epoxy-4alpha,5alpha-dihydroxyergosta-2,22-dien-7-one (CHEBI:227995) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(1R,4aR,5R,8S,8aR)-5-methyl-2-methylidene-8-propan-2-yl-1,3,4,5,6,7,8,8a-octahydronaphthalene-1,4a-diol
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9543335ChemSpider