| Properties | Image |
| MNX_ID | MNXM1124744 |
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| reference | chebi:162149 |
| formula | C12H20N4O7 |
| global charge | 0 |
| mol weight | 332.313 |
| InChIKey | MFJAPSYJQJCQDN-BQBZGAKWSA-N |
| InChI | InChI=1S/C12H20N4O7/c13-6(1-3-8(14)17)11(21)15-5-9(18)16-7(12(22)23)2-4-10(19)20/h6-7H,1-5,13H2,(H2,14,17)(H,15,21)(H,16,18)(H,19,20)(H,22,23)/t6-,7-/m0/s1 |
| SMILES | NC(=O)CC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C12H20N4O7/c13-6(1-3-8(14)17)11(21)15-5-9(18)16-7(12(22)23)2-4-10(19)20/h6-7H,1-5,13H2,(H2,14,17)(H,15,21)(H,16,18)(H,19,20)(H,22,23)/t6-,7-/m0/s1 |
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| SMILES (mnx) | [CH2:1]([CH2:3][C:8](=[NH:14])[OH:17])[C@@H:6]([C:11](=[N:15][CH2:5][C:9](=[N:16][C@@H:7]([CH2:2][CH2:4][C:10](=[O:19])[OH:20])[C:12](=[O:22])[OH:23])[OH:18])[OH:21])[NH2:13] |
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