Sinapoyl malate
Molecular Formula:
C15H16O9
InChI: InChI=1/C15H16O9/c1-22-9-5-8(6-10(23-2)14(9)19)3-4-13(18)24-11(15(20)21)7-12(16)17/h3-6,11,19H,7H2,1-2H3,(H,16,17)(H,20,21)/b4-3+/t11-/m0/s1/f/h16,20H
InChIKey: InChIKey=DUDGAPSRYCQPBG-OCXXXNGZDJ
SMILES: COC1=CC(=CC(=C1O)OC)C=CC(=O)OC(CC(=O)O)C(=O)O
Names:
C02887
Sinapoyl malate
Sinapoyl-(S)-malate
(2S)-2-[(E)-3-(4-hydroxy-3,5-dimethoxy-phenyl)prop-2-enoyl]oxybutanedioic acid
Registries:
PubChem CID 11953815
PubChem ID 5818
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