6-epi-ophiobolin K (CHEBI:207154)

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CHEBI:207154 - 6-epi-ophiobolin K

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ChEBI ID	CHEBI:207154
ChEBI Name	6-epi-ophiobolin K
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C25H36O3
Net Charge	0
Average Mass	384.560
Monoisotopic Mass	384.26645
SMILES	CC(C)=C/C=C\[C@H](C)C1CC[C@]2(C)C[C@H]3[C@@H](C(=O)C[C@@]3(C)O)C(C=O)=CC[C@@H]12
InChI	InChI=1S/C25H36O3/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/h6-9,15,17,19-21,23,28H,10-14H2,1-5H3/b8-6-,18-9?/t17-,19?,20-,21-,23-,24+,25+/m0/s1
InChIKey	TXEVVAPERSDMTN-YIOOYFDPSA-N

Species of Metabolite	Component	Source	Comments
Aspergillusspecies (ncbitaxon:5065)	-	DOI (10.1016/s0040-4020(01)96148-4)

ChEBI Ontology

Outgoing Relation(s)
	6-epi-ophiobolin K (CHEBI:207154) is a sesterterpenoid (CHEBI:26660)

IUPAC Name
(1R,3S,4R,7R,11S)-4-hydroxy-1,4-dimethyl-12-[(2S,3Z)-6-methylhepta-3,5-dien-2-yl]-6-oxotricyclo[9.3.0.03,7]tetradec-8-ene-8-carbaldehyde