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CHEBI:202598 - 6-epi-ophiobolin C

ChEBI IDCHEBI:202598
ChEBI Name6-epi-ophiobolin C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC25H38O3
Net Charge0
Average Mass386.576
Monoisotopic Mass386.28210
SMILESCC(C)=CCC[C@H](C)C1CC[C@]2(C)C[C@H]3C(C(=O)C[C@@]3(C)O)/C(C=O)=C\CC12
InChIInChI=1S/C25H38O3/c1-16(2)7-6-8-17(3)19-11-12-24(4)13-21-23(22(27)14-25(21,5)28)18(15-26)9-10-20(19)24/h7,9,15,17,19-21,23,28H,6,8,10-14H2,1-5H3/b18-9-/t17-,19?,20?,21-,23?,24+,25+/m0/s1
InChIKeyPLWMYIADTRHIMY-BEWCXZENSA-N
Species of MetaboliteComponentSourceComments
Aspergillus stellatus (ncbitaxon:1549217) - DOI (10.1016/s0040-4039(00)72403-8)
ChEBI Ontology
Outgoing Relation(s)
6-epi-ophiobolin C (CHEBI:202598) is a sesterterpenoid (CHEBI:26660)
IUPAC Name 
(1R,3S,4R,8E)-4-hydroxy-1,4-dimethyl-12-[(2S)-6-methylhept-5-en-2-yl]-6-oxotricyclo[9.3.0.03,7]tetradec-8-ene-8-carbaldehyde
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10480219ChemSpider