nogalaviketone
Chemical Formula:
C21H16O8
Molecular Weight:
396.353 Daltons
Monoisotopic Mass:
396.0845174904 Daltons
SMILES:
CC1(O)(CC(=O)C2(=C(C(C(OC)=O)1)C=C3(C(=C(O)2)C(=O)C4(=C(C(=O)3)C=CC=C(O)4))))
InChI:
1S/C21H16O8/c1-21(28)7-12(23)14-9(16(21)20(27)29-2)6-10-15(19(14)26)18(25)13-8(17(10)24)4-3-5-11(13)22/h3-6,16,22,26,28H,7H2,1-2H3/t16-,21-/m0/s1
InChIKey:
Synonyms
- methyl 5,7-dihydroxy-2-methyl-4,6,11-trioxo-3,4,6,11-tetrahydrotetracene-1-carboxylate
Databases
MetaCyc:
CPD-15808
ChEBI:
81874
KEGG:
C18630
PubChem (CID):
53297389
Seed:
cpd19893
MetaNetX:
MNXM12475