an SQDG(36:6)

Properties Image MNX_ID MNXM1134780 reference metacycM:SQDG-36-6 formula C11H15O12S*2 global charge -1 mol weight   InChIKey   InChI   SMILES [*]C(=O)OC[C@H](CO[C@H]1O[C@H](CS(=O)(=O)[O-])[C@@H](O)[C@H](O)[C@H]1O)OC([*])=O MNX internals InChI (mnx) InChI=1/C13H22O12S/c1-6(14)22-3-8(24-7(2)15)4-23-13-12(18)11(17)10(16)9(25-13)5-26(19,20)21/h8-13,16-18H,3-5H2,1-2H3,(H,19,20,21)/t8-,9-,10-,11+,12-,13+/m1/s1/i1+1,2+1 SMILES (mnx) [13CH3:1][C:6](=[O:14])[O:22][CH2:3][C@H:8]([CH2:4][O:23][C@@H:13]1[C@H:12]([OH:18])[C@@H:11]([OH:17])[C@H:10]([OH:16])[C@@H:9]([CH2:5][S:26]([OH:19])(=[O:20])=[O:21])[O:25]1)[O:24][C:7]([13CH3:2])=[O:15]

Parent-child relations graph

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