3,5-dioxo-6-[4,5,7-trihydroxy-3-(3-oxobutanoyl)naphthalen-2-yl]hexanoate
![3,5-dioxo-6-[4,5,7-trihydroxy-3-(3-oxobutanoyl)naphthalen-2-yl]hexanoate](/media/image_cpd/svg/CPD-16647.svg)
Chemical Formula:
C20H17O9
Molecular Weight:
401.349 Daltons
Monoisotopic Mass:
402.0950821767 Daltons
SMILES:
CC(=O)CC(=O)C1(C(CC(=O)CC(=O)CC([O-])=O)=CC2(=CC(=CC(O)=C(C=1O)2)O))
InChI:
1S/C20H18O9/c1-9(21)2-15(25)18-10(4-12(22)6-14(24)8-17(27)28)3-11-5-13(23)7-16(26)19(11)20(18)29/h3,5,7,23,26,29H,2,4,6,8H2,1H3,(H,27,28)/p-1
InChIKey:
Synonyms
- 3,5-dioxo-6-[4,5,7-trihydroxy-3-(3-oxobutanoyl)naphthalen-2-yl]hexanoic acid
Databases
MetaCyc:
CPD-16647
PubChem (CID):
90659064
MetaNetX:
MNXM147762