| Properties | Image |
MNX_ID | MNXM102291 |
 |
reference | chebi:71946 |
formula | C12H22O10 |
global charge | 0 |
mol weight | 326.298 |
InChIKey | WXNQRDORCOIMDY-NNWZRRJQSA-N |
InChI | InChI=1S/C12H22O10/c13-2-1-4-7(16)10(9(18)11(19)20-4)22-12-8(17)6(15)5(3-14)21-12/h4-19H,1-3H2/t4-,5-,6-,7+,8+,9-,10-,11+,12-/m0/s1 |
SMILES | OCC[C@@H]1O[C@@H](O)[C@@H](O)[C@@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)[C@@H]1O |
MNX internals
InChI (mnx) | InChI=1/C12H22O10/c13-2-1-4-7(16)10(9(18)11(19)20-4)22-12-8(17)6(15)5(3-14)21-12/h4-19H,1-3H2/t4-,5-,6-,7+,8+,9-,10-,11+,12-/m0/s1 |
 |
SMILES (mnx) | [CH2:1]([CH2:2][OH:13])[C@H:4]1[C@@H:7]([OH:16])[C@H:10]([O:22][C@H:12]2[C@H:8]([OH:17])[C@@H:6]([OH:15])[C@H:5]([CH2:3][OH:14])[O:21]2)[C@H:9]([OH:18])[C@H:11]([OH:19])[O:20]1 |
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