| Properties | Image |
| MNX_ID | MNXM1595889 |
 |
| reference | vmhM:olodsulf vmhM:olodsulf |
| formula | C20H24N2O8S |
| global charge | 0 |
| mol weight | 452.485 |
| InChIKey | WFWBNMBOJMUVDA-QGZVFWFLSA-N |
| InChI | InChI=1S/C20H24N2O8S/c1-20(2,9-12-3-5-14(6-4-12)30-31(26,27)28)21-10-17(24)15-7-13(23)8-16-19(15)29-11-18(25)22-16/h3-8,17,21,23-24H,9-11H2,1-2H3,(H,22,25)(H,26,27,28)/t17-/m1/s1 |
| SMILES | CC(C)(Cc1ccc(OS(=O)(=O)[O-])cc1)[NH2+]C[C@@H](O)c1cc(O)cc2c1OCC(=O)N2 |
MNX internals
| InChI (mnx) | InChI=1/C20H24N2O8S/c1-20(2,9-12-3-5-14(6-4-12)30-31(26,27)28)21-10-17(24)15-7-13(23)8-16-19(15)29-11-18(25)22-16/h3-8,17,21,23-24H,9-11H2,1-2H3,(H,22,25)(H,26,27,28)/t17-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][C:20]([CH3:2])([CH2:9][c:12]1[cH:3][cH:5][c:14]([O:30][S:31]([OH:26])(=[O:27])=[O:28])[cH:6][cH:4]1)[NH:21][CH2:10][C@H:17]([c:15]1[cH:7][c:13]([OH:23])[cH:8][c:16]2[c:19]1[O:29][CH2:11][C:18](=[O:25])[NH:22]2)[OH:24] |
|