| Properties | Image |
| MNX_ID | MNXM1121576 |
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| reference | chebi:158964 |
| formula | C12H23N7O5 |
| global charge | 0 |
| mol weight | 345.36 |
| InChIKey | PNIGSVZJNVUVJA-BQBZGAKWSA-N |
| InChI | InChI=1S/C12H23N7O5/c13-6(2-1-3-17-12(15)16)10(22)18-5-9(21)19-7(11(23)24)4-8(14)20/h6-7H,1-5,13H2,(H2,14,20)(H,18,22)(H,19,21)(H,23,24)(H4,15,16,17)/t6-,7-/m0/s1 |
| SMILES | NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H](N)CCCN=C(N)N)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C12H23N7O5/c13-6(2-1-3-17-12(15)16)10(22)18-5-9(21)19-7(11(23)24)4-8(14)20/h6-7H,1-5,13H2,(H2,14,20)(H,18,22)(H,19,21)(H,23,24)(H4,15,16,17)/t6-,7-/m0/s1 |
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| SMILES (mnx) | [CH2:1]([CH2:2][C@@H:6]([C:10](=[N:18][CH2:5][C:9](=[N:19][C@@H:7]([CH2:4][C:8](=[NH:14])[OH:20])[C:11](=[O:23])[OH:24])[OH:21])[OH:22])[NH2:13])[CH2:3][NH:17][C:12](=[NH:15])[NH2:16] |
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