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CHEBI:205876 - Oxirapentyn F

ChEBI IDCHEBI:205876
ChEBI NameOxirapentyn F
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SubmitterMetaboLights
DownloadsMolfile
FormulaC18H24O7
Net Charge0
Average Mass352.383
Monoisotopic Mass352.15220
SMILESC=C(C)C#C[C@]1(O)[C@@H](O)[C@@H]2OC(C)(C)[C@H](OC(C)=O)C[C@@]23O[C@H]3[C@@H]1O
InChIInChI=1S/C18H24O7/c1-9(2)6-7-17(22)12(20)14-18(15(25-18)13(17)21)8-11(23-10(3)19)16(4,5)24-14/h11-15,20-22H,1,8H2,2-5H3/t11-,12+,13+,14+,15+,17+,18-/m1/s1
InChIKeyCKOXTYVYLDHQFC-CSJOOHGPSA-N
Species of MetaboliteComponentSourceComments
Isaria (ncbitaxon:72232) - PubMed (24911656)
ChEBI Ontology
Outgoing Relation(s)
Oxirapentyn F (CHEBI:205876) is a oxacycle (CHEBI:38104)
IUPAC Name 
[(1aS,2S,3S,4S,4aS,7R,8aS)-2,3,4-trihydroxy-6,6-dimethyl-3-(3-methylbut-3-en-1-ynyl)-1a,2,4,4a,7,8-hexahydrooxireno[2,3-e]chromen-7-yl] acetate
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32674934ChemSpider