aklanonate
Chemical Formula:
C21H15O8
Molecular Weight:
395.345 Daltons
Monoisotopic Mass:
396.0845174904 Daltons
SMILES:
CCC(=O)CC(=O)C1(=C(CC([O-])=O)C=C2(C(=C(O)1)C(=O)C3(=C(C(=O)2)C=CC=C(O)3)))
InChI:
1S/C21H16O8/c1-2-10(22)8-14(24)16-9(7-15(25)26)6-12-18(20(16)28)21(29)17-11(19(12)27)4-3-5-13(17)23/h3-6,23,28H,2,7-8H2,1H3,(H,25,26)/p-1
InChIKey:
Synonyms
- aklanonic acid
Databases
MetaCyc:
CPD-15738
PubChem (CID):
71668309
ChEBI:
75309
Seed:
cpd09173
MetaNetX:
MNXM7035
KEGG:
C12421