| Properties | Image |
|---|
| MNX_ID | MNXM164182 |
 |
| reference | keggC:C21176 |
| formula | C17H32N4O10 |
| global charge | 0 |
| mol weight | 452.461 |
| InChIKey | DPLDETAGGMBAAD-JBMHXFFBSA-N |
| InChI | InChI=1S/C17H32N4O10/c18-2-6-10(24)12(26)8(21)16(28-6)30-14-5(20)1-4(19)9(23)15(14)31-17-13(27)11(25)7(3-22)29-17/h4-10,12-17,22-24,26-27H,1-3,18-21H2/t4-,5+,6-,7-,8-,9+,10-,12-,13-,14-,15-,16-,17+/m1/s1 |
| SMILES | NC[C@H]1O[C@H](O[C@H]2[C@H](O[C@@H]3O[C@H](CO)C(=O)[C@H]3O)[C@@H](O)[C@H](N)C[C@@H]2N)[C@H](N)[C@@H](O)[C@@H]1O |
MNX internals
| InChI (mnx) | InChI=1/C17H32N4O10/c18-2-6-10(24)12(26)8(21)16(28-6)30-14-5(20)1-4(19)9(23)15(14)31-17-13(27)11(25)7(3-22)29-17/h4-10,12-17,22-24,26-27H,1-3,18-21H2/t4-,5+,6-,7-,8-,9+,10-,12-,13-,14-,15-,16-,17+/m1/s1 |
 |
| SMILES (mnx) | [CH2:1]1[C@@H:4]([NH2:19])[C@H:9]([OH:23])[C@@H:15]([O:31][C@H:17]2[C@H:13]([OH:27])[C:11](=[O:25])[C@@H:7]([CH2:3][OH:22])[O:29]2)[C@H:14]([O:30][C@@H:16]2[C@H:8]([NH2:21])[C@@H:12]([OH:26])[C@H:10]([OH:24])[C@@H:6]([CH2:2][NH2:18])[O:28]2)[C@H:5]1[NH2:20] |
|