| Properties | Image |
| MNX_ID | MNXM1122957 |
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| reference | chebi:160355 |
| formula | C15H28N6O6 |
| global charge | 0 |
| mol weight | 388.425 |
| InChIKey | XYBJLTKSGFBLCS-QXEWZRGKSA-N |
| InChI | InChI=1S/C15H28N6O6/c1-7(2)11(14(26)27)21-13(25)9(4-3-5-19-15(17)18)20-12(24)8(16)6-10(22)23/h7-9,11H,3-6,16H2,1-2H3,(H,20,24)(H,21,25)(H,22,23)(H,26,27)(H4,17,18,19)/t8-,9-,11-/m0/s1 |
| SMILES | CC(C)[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CC(=O)O)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C15H28N6O6/c1-7(2)11(14(26)27)21-13(25)9(4-3-5-19-15(17)18)20-12(24)8(16)6-10(22)23/h7-9,11H,3-6,16H2,1-2H3,(H,20,24)(H,21,25)(H,22,23)(H,26,27)(H4,17,18,19)/t8-,9-,11-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH:7]([CH3:2])[C@@H:11]([C:14](=[O:26])[OH:27])[N:21]=[C:13]([C@H:9]([CH2:4][CH2:3][CH2:5][NH:19][C:15](=[NH:17])[NH2:18])[N:20]=[C:12]([C@H:8]([CH2:6][C:10](=[O:22])[OH:23])[NH2:16])[OH:24])[OH:25] |
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