Maximiscin (CHEBI:214451)

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CHEBI:214451 - Maximiscin

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ChEBI ID	CHEBI:214451
ChEBI Name	Maximiscin
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C23H31NO8
Net Charge	0
Average Mass	449.500
Monoisotopic Mass	449.20497
SMILES	C=C[C@@H]1C[C@H](C)C[C@H](C)[C@H]1c1c(O)ccn(O[C@@H]2C(C(=O)OC)=C[C@H](O)[C@H](O)[C@@H]2O)c1=O
InChI	InChI=1S/C23H31NO8/c1-5-13-9-11(2)8-12(3)17(13)18-15(25)6-7-24(22(18)29)32-21-14(23(30)31-4)10-16(26)19(27)20(21)28/h5-7,10-13,16-17,19-21,25-28H,1,8-9H2,2-4H3/t11-,12+,13-,16+,17-,19+,20+,21-/m1/s1
InChIKey	BHUFOFQGYXAGAC-XMGLCDBZSA-N

Species of Metabolite	Component	Source	Comments
Tolypocladiumspecies (ncbitaxon:1856741)	-	PubMed (24285637)

ChEBI Ontology

Outgoing Relation(s)
	Maximiscin (CHEBI:214451) is a carbonyl compound (CHEBI:36586)

IUPAC Name
methyl (3S,4S,5S,6R)-6-[3-[(1R,2S,4R,6S)-2-ethenyl-4,6-dimethylcyclohexyl]-4-hydroxy-2-oxopyridin-1-yl]oxy-3,4,5-trihydroxycyclohexene-1-carboxylate

Manual Xrefs	Databases
34485502	ChemSpider