Manumycin G (CHEBI:202944)

EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:202944 - Manumycin G

Take structure to advanced search

ChEBI ID	CHEBI:202944
ChEBI Name	Manumycin G
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C28H30N2O7
Net Charge	0
Average Mass	506.555
Monoisotopic Mass	506.20530
SMILES	CC(C)/C=C/C=C/C=C/C(=O)NC1=C[C@@](O)(/C=C/C=C/C=C/C(=O)NC2=C(O)CCC2=O)C2OC2C1=O
InChI	InChI=1S/C28H30N2O7/c1-18(2)11-7-3-4-8-12-22(33)29-19-17-28(36,27-26(37-27)25(19)35)16-10-6-5-9-13-23(34)30-24-20(31)14-15-21(24)32/h3-13,16-18,26-27,31,36H,14-15H2,1-2H3,(H,29,33)(H,30,34)/b4-3+,6-5+,11-7+,12-8+,13-9+,16-10+/t26?,27?,28-/m0/s1
InChIKey	WIFRXHSYMJBOJD-WGTDVQNWSA-N

Species of Metabolite	Component	Source	Comments
Streptomyces (ncbitaxon:1883)	-	PubMed (8175485)

ChEBI Ontology

Outgoing Relation(s)
	Manumycin G (CHEBI:202944) is a cyclohexenones (CHEBI:48953)

IUPAC Name
(2E,4E,6E)-N-[(5S)-5-hydroxy-5-[(1E,3E,5E)-7-[(2-hydroxy-5-oxocyclopenten-1-yl)amino]-7-oxohepta-1,3,5-trienyl]-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]-8-methylnona-2,4,6-trienamide

Manual Xrefs	Databases
8227482	ChemSpider