| Properties | Image |
| MNX_ID | MNXM38225 |
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| reference | chebi:20605 |
| formula | C11H17N3O6 |
| global charge | 0 |
| mol weight | 287.272 |
| InChIKey | ZXQHKBUIXRFZBV-FDDDBJFASA-N |
| InChI | InChI=1S/C11H17N3O6/c1-12-2-5-3-14(11(19)13-9(5)18)10-8(17)7(16)6(4-15)20-10/h3,6-8,10,12,15-17H,2,4H2,1H3,(H,13,18,19)/t6-,7-,8-,10-/m1/s1 |
| SMILES | CNCC1=CN([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C(=O)NC1=O |
MNX internals
| InChI (mnx) | InChI=1/C11H17N3O6/c1-12-2-5-3-14(11(19)13-9(5)18)10-8(17)7(16)6(4-15)20-10/h3,6-8,10,12,15-17H,2,4H2,1H3,(H,13,18,19)/t6-,7-,8-,10-/m1/s1 |
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| SMILES (mnx) | [CH3:1][NH:12][CH2:2][C:5]1=[CH:3][N:14]([C@H:10]2[C@H:8]([OH:17])[C@H:7]([OH:16])[C@@H:6]([CH2:4][OH:15])[O:20]2)[C:11](=[O:19])[N:13]=[C:9]1[OH:18] |
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