globosumone C

Properties Image MNX_ID MNXM105381 reference chebi:68707 formula C13H16O7 global charge 0 mol weight 284.264 InChIKey QKZBVIRYEJQQDG-MADCSZMMSA-N InChI InChI=1S/C13H16O7/c1-6-3-8(15)4-9(16)11(6)13(19)20-5-10(17)12(18)7(2)14/h3-4,7,12,14-16,18H,5H2,1-2H3/t7-,12-/m0/s1 SMILES CC1=CC(O)=CC(O)=C1C(=O)OCC(=O)[C@@H](O)[C@H](C)O MNX internals InChI (mnx) InChI=1/C13H16O7/c1-6-3-8(15)4-9(16)11(6)13(19)20-5-10(17)12(18)7(2)14/h3-4,7,12,14-16,18H,5H2,1-2H3/t7-,12-/m0/s1 SMILES (mnx) [CH3:1][C:6]1=[CH:3][C:8]([OH:15])=[CH:4][C:9]([OH:16])=[C:11]1[C:13](=[O:19])[O:20][CH2:5][C:10]([C@H:12]([C@H:7]([CH3:2])[OH:14])[OH:18])=[O:17]

Parent-child relations graph

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