3-(6-sulfo-alpha-D-quinovosyl)glycerol

Properties Image MNX_ID MNXM165453 reference chebi:190012 formula C9H17O10S global charge -1 mol weight 317.292 InChIKey JTXHNMDHGMNPEG-NZJLWHDDSA-M InChI InChI=1S/C9H18O10S/c10-1-4(11)2-18-9-8(14)7(13)6(12)5(19-9)3-20(15,16)17/h4-14H,1-3H2,(H,15,16,17)/p-1/t4-,5-,6-,7+,8-,9+/m1/s1 SMILES O=S(=O)([O-])C[C@H]1O[C@H](OC[C@H](O)CO)[C@H](O)[C@@H](O)[C@@H]1O MNX internals InChI (mnx) InChI=1/C9H18O10S/c10-1-4(11)2-18-9-8(14)7(13)6(12)5(19-9)3-20(15,16)17/h4-14H,1-3H2,(H,15,16,17)/t4-,5-,6-,7+,8-,9+/m1/s1 SMILES (mnx) [CH2:1]([C@H:4]([CH2:2][O:18][C@@H:9]1[C@H:8]([OH:14])[C@@H:7]([OH:13])[C@H:6]([OH:12])[C@@H:5]([CH2:3][S:20]([OH:15])(=[O:16])=[O:17])[O:19]1)[OH:11])[OH:10]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 1