2-Galloyl-1,4-galactarolactone methyl ester

Properties Image MNX_ID MNXM116740 reference chebi:174789 formula C14H14O11 global charge 0 mol weight 358.255 InChIKey DTDWLEXEERIYFQ-UHFFFAOYSA-N InChI InChI=1S/C14H14O11/c1-23-13(21)9(19)10-8(18)11(14(22)24-10)25-12(20)4-2-5(15)7(17)6(16)3-4/h2-3,8-11,15-19H,1H3 SMILES COC(=O)C(O)C1OC(=O)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O MNX internals InChI (mnx) InChI=1/C14H14O11/c1-23-13(21)9(19)10-8(18)11(14(22)24-10)25-12(20)4-2-5(15)7(17)6(16)3-4/h2-3,8-11,15-19H,1H3/t8?,9?,10?,11? SMILES (mnx) [CH3:1][O:23][C:13]([CH:9]([CH:10]1[CH:8]([OH:18])[CH:11]([O:25][C:12]([C:4]2=[CH:2][C:5]([OH:15])=[C:7]([OH:17])[C:6]([OH:16])=[CH:3]2)=[O:20])[C:14](=[O:22])[O:24]1)[OH:19])=[O:21]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0