(2S,3S,4S,5R,6S)-6-(6-carboxy-8-hydroxy-9,10-dioxo-anthracen-1-yl)oxy-3,4,5-trihydroxy-oxane-2-carboxylic acid
Molecular Formula:
C21H16O12
InChI: InChI=1/C21H16O12/c22-9-5-6(19(28)29)4-8-11(9)14(24)12-7(13(8)23)2-1-3-10(12)32-21-17(27)15(25)16(26)18(33-21)20(30)31/h1-5,15-18,21-22,25-27H,(H,28,29)(H,30,31)/t15-,16-,17+,18-,21+/m0/s1/f/h28,30H
InChIKey: InChIKey=PCIJYIRYSXMDQB-SCULLBEHDG
SMILES: C1=CC2=C(C(=C1)OC3C(C(C(C(O3)C(=O)O)O)O)O)C(=O)C4=C(C=C(C=C4C2=O)C(=O)O)O
Names:
(2S,3S,4S,5R,6S)-6-(6-carboxy-8-hydroxy-9,10-dioxo-anthracen-1-yl)oxy-3,4,5-trihydroxy-oxane-2-carboxylic acid
Registries:
PubChem CID 156112
PubChem ID 10252810
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