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CHEBI:208699 - Ophiobolin Y

ChEBI IDCHEBI:208699
ChEBI NameOphiobolin Y
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H40O3
Net Charge0
Average Mass400.603
Monoisotopic Mass400.29775
SMILESCO[C@H]1C[C@H]2[C@@H]([C@@H](C)/C=C\C=C(C)C)CC[C@]2(C)C[C@H]2[C@H]3C1=CO[C@H]3C[C@@]2(C)O
InChIInChI=1S/C26H40O3/c1-16(2)8-7-9-17(3)18-10-11-25(4)13-21-24-19(22(28-6)12-20(18)25)15-29-23(24)14-26(21,5)27/h7-9,15,17-18,20-24,27H,10-14H2,1-6H3/b9-7-/t17-,18+,20-,21-,22-,23-,24+,25+,26+/m0/s1
InChIKeyVQNZJDUMTPVGDO-HUMFLCGESA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (29286660)
ChEBI Ontology
Outgoing Relation(s)
Ophiobolin Y (CHEBI:208699) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(1S,3R,6R,7S,9S,13S,15R,16S)-9-methoxy-3,15-dimethyl-6-[(2S,3Z)-6-methylhepta-3,5-dien-2-yl]-12-oxatetracyclo[8.5.1.03,7.013,16]hexadec-10-en-15-ol
Manual XrefsDatabases
64808802ChemSpider