1-[4,5,7,10-tetrahydroxy-3-(3-oxobutanoyl)anthracen-2-yl]pentane-1,2,4-trione

Chemical Formula:

C₂₃H₁₆O₉

Molecular Weight:

436.374 Daltons

Monoisotopic Mass:

438.0950821767 Daltons

SMILES:

CC(=O)CC(=O)C1(C(C(=O)C([C-]C(=O)C)=O)=CC2(=C(C([O-])=1)C(O)=C3(C(=C2)C=C(O)C=C(O)3)))

InChI:

1S/C23H17O9/c1-9(24)3-15(27)20-14(21(30)17(29)4-10(2)25)7-12-5-11-6-13(26)8-16(28)18(11)22(31)19(12)23(20)32/h4-8,26,28,31-32H,3H2,1-2H3/q-1/p-1

InChIKey:

DVKUYLIKHYAIMK-UHFFFAOYSA-M

Databases

MetaCyc: CPD-14365

PubChem (CID): 90657498

Seed: cpd24320

MetaNetX: MNXM97370