| Properties | Image |
| MNX_ID | MNXM1125531 |
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| reference | chebi:162943 |
| formula | C11H17N3O9 |
| global charge | 0 |
| mol weight | 335.269 |
| InChIKey | MESDJCNHLZBMEP-ZLUOBGJFSA-N |
| InChI | InChI=1S/C11H17N3O9/c12-4(3-15)9(20)13-5(1-7(16)17)10(21)14-6(11(22)23)2-8(18)19/h4-6,15H,1-3,12H2,(H,13,20)(H,14,21)(H,16,17)(H,18,19)(H,22,23)/t4-,5-,6-/m0/s1 |
| SMILES | N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C11H17N3O9/c12-4(3-15)9(20)13-5(1-7(16)17)10(21)14-6(11(22)23)2-8(18)19/h4-6,15H,1-3,12H2,(H,13,20)(H,14,21)(H,16,17)(H,18,19)(H,22,23)/t4-,5-,6-/m0/s1 |
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| SMILES (mnx) | [CH2:1]([C@@H:5]([C:10](=[N:14][C@@H:6]([CH2:2][C:8](=[O:18])[OH:19])[C:11](=[O:22])[OH:23])[OH:21])[N:13]=[C:9]([C@H:4]([CH2:3][OH:15])[NH2:12])[OH:20])[C:7](=[O:16])[OH:17] |
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