A-80915G-8"-acid (CHEBI:207781)

EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:207781 - A-80915G-8"-acid

Take structure to advanced search

ChEBI ID	CHEBI:207781
ChEBI Name	A-80915G-8"-acid
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C25H28O7
Net Charge	0
Average Mass	440.492
Monoisotopic Mass	440.18350
SMILES	CC(C)=CC[C@]12O[C@@]1(C/C=C(\C)CC/C=C(\C)C(=O)O)C(=O)c1cc(O)cc(O)c1C2=O
InChI	InChI=1S/C25H28O7/c1-14(2)8-10-25-22(29)20-18(12-17(26)13-19(20)27)21(28)24(25,32-25)11-9-15(3)6-5-7-16(4)23(30)31/h7-9,12-13,26-27H,5-6,10-11H2,1-4H3,(H,30,31)/b15-9+,16-7+/t24-,25+/m0/s1
InChIKey	AKNFWTRLIQUPJV-OYQNMOSVSA-N

Species of Metabolite	Component	Source	Comments
Streptomyces (ncbitaxon:1883)	-	PubMed (18408326)

ChEBI Ontology

Outgoing Relation(s)
	A-80915G-8"-acid (CHEBI:207781) is a menaquinones (CHEBI:25185)

IUPAC Name
(2E,6E)-8-[(1aR,7aS)-4,6-dihydroxy-7a-(3-methylbut-2-enyl)-2,7-dioxonaphtho[2,3-b]oxiren-1a-yl]-2,6-dimethylocta-2,6-dienoic acid

Manual Xrefs	Databases
27023354	ChemSpider