| Properties | Image |
MNX_ID | MNXM12343 |
 |
reference | chebi:79981 |
formula | C14H22NO12* |
global charge | 0 |
mol weight | |
InChIKey | |
InChI | |
SMILES | [*]O[C@@H]1O[C@H](C(=O)O)[C@@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)[C@H](O)[C@H]1O |
MNX internals
InChI (mnx) | InChI=1/C15H25NO12/c1-4(18)16-6-8(20)7(19)5(3-17)26-14(6)27-11-9(21)10(22)15(25-2)28-12(11)13(23)24/h5-12,14-15,17,19-22H,3H2,1-2H3,(H,16,18)(H,23,24)/t5-,6-,7-,8-,9-,10-,11+,12+,14-,15-/m1/s1/i2+1 |
 |
SMILES (mnx) | [CH3:1][C:4](=[N:16][C@@H:6]1[C@@H:8]([OH:20])[C@H:7]([OH:19])[C@@H:5]([CH2:3][OH:17])[O:26][C@@H:14]1[O:27][C@H:11]1[C@H:9]([OH:21])[C@@H:10]([OH:22])[C@H:15]([O:25][13CH3:2])[O:28][C@@H:12]1[C:13](=[O:23])[OH:24])[OH:18] |
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