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alloin

PubChem CID 9866696· C21H22O9

Molecular formula
C21H22O9
Molecular weight
418.4 g/mol
IUPAC name
1,8-dihydroxy-3-(hydroxymethyl)-10-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-10H-anthracen-9-one
SMILES
C1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C(C(C(C(O4)CO)O)O)O)C=C(C=C3O)CO
InChIKey
AFHJQYHRLPMKHU-CGISPIQUSA-N