| Properties | Image |
| MNX_ID | MNXM1121860 |
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| reference | chebi:159249 |
| formula | C16H29N7O5 |
| global charge | 0 |
| mol weight | 399.452 |
| InChIKey | DNBMCNQKNOKOSD-DCAQKATOSA-N |
| InChI | InChI=1S/C16H29N7O5/c17-9(3-1-7-21-16(19)20)14(26)23-8-2-4-11(23)13(25)22-10(15(27)28)5-6-12(18)24/h9-11H,1-8,17H2,(H2,18,24)(H,22,25)(H,27,28)(H4,19,20,21)/t9-,10-,11-/m0/s1 |
| SMILES | NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCN=C(N)N)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C16H29N7O5/c17-9(3-1-7-21-16(19)20)14(26)23-8-2-4-11(23)13(25)22-10(15(27)28)5-6-12(18)24/h9-11H,1-8,17H2,(H2,18,24)(H,22,25)(H,27,28)(H4,19,20,21)/t9-,10-,11-/m0/s1 |
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| SMILES (mnx) | [CH2:1]([CH2:3][C@@H:9]([C:14]([N:23]1[CH2:8][CH2:2][CH2:4][C@H:11]1[C:13](=[N:22][C@@H:10]([CH2:5][CH2:6][C:12](=[NH:18])[OH:24])[C:15](=[O:27])[OH:28])[OH:25])=[O:26])[NH2:17])[CH2:7][NH:21][C:16](=[NH:19])[NH2:20] |
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