flavan-3,3',4',5,5',7-hexol

Properties Image MNX_ID MNXM125689 reference chebi:71224 formula C15H14O7 global charge 0 mol weight 306.27 InChIKey XMOCLSLCDHWDHP-UHFFFAOYSA-N InChI InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2 SMILES OC1=CC2=C(CC(O)C(C3=CC(O)=C(O)C(O)=C3)O2)C(O)=C1 MNX internals InChI (mnx) InChI=1/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12?,15? SMILES (mnx) [CH:1]1=[C:6]([CH:15]2[CH:12]([OH:20])[CH2:5][C:8]3=[C:9]([OH:17])[CH:3]=[C:7]([OH:16])[CH:4]=[C:13]3[O:22]2)[CH:2]=[C:11]([OH:19])[C:14]([OH:21])=[C:10]1[OH:18]

Parent-child relations graph

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