| Properties | Image |
| MNX_ID | MNXM1122312 |
 |
| reference | chebi:159704 |
| formula | C15H31N7O4 |
| global charge | 0 |
| mol weight | 373.458 |
| InChIKey | WXJKFRMKJORORD-DCAQKATOSA-N |
| InChI | InChI=1S/C15H31N7O4/c1-9(14(25)26)21-13(24)11(6-4-8-20-15(18)19)22-12(23)10(17)5-2-3-7-16/h9-11H,2-8,16-17H2,1H3,(H,21,24)(H,22,23)(H,25,26)(H4,18,19,20)/t9-,10-,11-/m0/s1 |
| SMILES | C[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CCCCN)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C15H31N7O4/c1-9(14(25)26)21-13(24)11(6-4-8-20-15(18)19)22-12(23)10(17)5-2-3-7-16/h9-11H,2-8,16-17H2,1H3,(H,21,24)(H,22,23)(H,25,26)(H4,18,19,20)/t9-,10-,11-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C@@H:9]([C:14](=[O:25])[OH:26])[N:21]=[C:13]([C@H:11]([CH2:6][CH2:4][CH2:8][NH:20][C:15](=[NH:18])[NH2:19])[N:22]=[C:12]([C@H:10]([CH2:5][CH2:2][CH2:3][CH2:7][NH2:16])[NH2:17])[OH:23])[OH:24] |
|