| Properties | Image |
| MNX_ID | MNXM1120568 |
 |
| reference | chebi:157949 |
| formula | C12H24N6O4S |
| global charge | 0 |
| mol weight | 348.429 |
| InChIKey | WRDANSJTFOHBPI-FXQIFTODSA-N |
| InChI | InChI=1S/C12H24N6O4S/c1-6(13)9(19)17-7(3-2-4-16-12(14)15)10(20)18-8(5-23)11(21)22/h6-8,23H,2-5,13H2,1H3,(H,17,19)(H,18,20)(H,21,22)(H4,14,15,16)/t6-,7-,8-/m0/s1 |
| SMILES | C[C@H](N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CS)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C12H24N6O4S/c1-6(13)9(19)17-7(3-2-4-16-12(14)15)10(20)18-8(5-23)11(21)22/h6-8,23H,2-5,13H2,1H3,(H,17,19)(H,18,20)(H,21,22)(H4,14,15,16)/t6-,7-,8-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C@@H:6]([C:9](=[N:17][C@@H:7]([CH2:3][CH2:2][CH2:4][NH:16][C:12](=[NH:14])[NH2:15])[C:10](=[N:18][C@@H:8]([CH2:5][SH:23])[C:11](=[O:21])[OH:22])[OH:20])[OH:19])[NH2:13] |
|