Neocitreoviridin (CHEBI:207547)

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CHEBI:207547 - Neocitreoviridin

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ChEBI ID	CHEBI:207547
ChEBI Name	Neocitreoviridin
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C23H30O6
Net Charge	0
Average Mass	402.487
Monoisotopic Mass	402.20424
SMILES	COc1cc(=O)oc(/C=C/C=C/C=C/C(C)=C\[C@]2(C)O[C@@H](C)[C@@](C)(O)[C@@H]2O)c1C
InChI	InChI=1S/C23H30O6/c1-15(14-22(4)21(25)23(5,26)17(3)29-22)11-9-7-8-10-12-18-16(2)19(27-6)13-20(24)28-18/h7-14,17,21,25-26H,1-6H3/b8-7+,11-9+,12-10+,15-14-/t17-,21+,22-,23+/m0/s1
InChIKey	JLSVDPQAIKFBTO-KFGWDFDJSA-N

Species of Metabolite	Component	Source	Comments
Penicillium (ncbitaxon:5073)	-	PubMed (28824581)

ChEBI Ontology

Outgoing Relation(s)
	Neocitreoviridin (CHEBI:207547) is a pyranone (CHEBI:37963)

IUPAC Name
6-[(1E,3E,5E,7Z)-8-[(2S,3S,4S,5S)-3,4-dihydroxy-2,4,5-trimethyloxolan-2-yl]-7-methylocta-1,3,5,7-tetraenyl]-4-methoxy-5-methylpyran-2-one

Manual Xrefs	Databases
62344039	ChemSpider