| Properties | Image |
| MNX_ID | MNXM1121721 |
 |
| reference | chebi:159110 |
| formula | C16H32N6O5 |
| global charge | 0 |
| mol weight | 388.469 |
| InChIKey | JEOCWTUOMKEEMF-RHYQMDGZSA-N |
| InChI | InChI=1S/C16H32N6O5/c1-8(2)7-11(14(25)22-12(9(3)23)15(26)27)21-13(24)10(17)5-4-6-20-16(18)19/h8-12,23H,4-7,17H2,1-3H3,(H,21,24)(H,22,25)(H,26,27)(H4,18,19,20)/t9-,10+,11+,12+/m1/s1 |
| SMILES | CC(C)C[C@H](NC(=O)[C@@H](N)CCCN=C(N)N)C(=O)N[C@H](C(=O)O)[C@@H](C)O |
MNX internals
| InChI (mnx) | InChI=1/C16H32N6O5/c1-8(2)7-11(14(25)22-12(9(3)23)15(26)27)21-13(24)10(17)5-4-6-20-16(18)19/h8-12,23H,4-7,17H2,1-3H3,(H,21,24)(H,22,25)(H,26,27)(H4,18,19,20)/t9-,10+,11+,12+/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH:8]([CH3:2])[CH2:7][C@@H:11]([C:14](=[N:22][C@@H:12]([C@@H:9]([CH3:3])[OH:23])[C:15](=[O:26])[OH:27])[OH:25])[N:21]=[C:13]([C@H:10]([CH2:5][CH2:4][CH2:6][NH:20][C:16](=[NH:18])[NH2:19])[NH2:17])[OH:24] |
|