| Properties | Image |
| MNX_ID | MNXM1123467 |
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| reference | chebi:160868 |
| formula | C10H17N3O7 |
| global charge | 0 |
| mol weight | 291.26 |
| InChIKey | WMLFFCRUSPNENW-ZLUOBGJFSA-N |
| InChI | InChI=1S/C10H17N3O7/c1-4(10(19)20)12-9(18)6(3-14)13-8(17)5(11)2-7(15)16/h4-6,14H,2-3,11H2,1H3,(H,12,18)(H,13,17)(H,15,16)(H,19,20)/t4-,5-,6-/m0/s1 |
| SMILES | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(=O)O)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C10H17N3O7/c1-4(10(19)20)12-9(18)6(3-14)13-8(17)5(11)2-7(15)16/h4-6,14H,2-3,11H2,1H3,(H,12,18)(H,13,17)(H,15,16)(H,19,20)/t4-,5-,6-/m0/s1 |
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| SMILES (mnx) | [CH3:1][C@@H:4]([C:10](=[O:19])[OH:20])[N:12]=[C:9]([C@H:6]([CH2:3][OH:14])[N:13]=[C:8]([C@H:5]([CH2:2][C:7](=[O:15])[OH:16])[NH2:11])[OH:17])[OH:18] |
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