| Properties | Image |
| MNX_ID | MNXM1125044 |
 |
| reference | chebi:162454 |
| formula | C11H20N4O6 |
| global charge | 0 |
| mol weight | 304.303 |
| InChIKey | KUBFPYIMAGXGBT-ACZMJKKPSA-N |
| InChI | InChI=1S/C11H20N4O6/c1-5(11(20)21)14-10(19)7(4-16)15-9(18)6(12)2-3-8(13)17/h5-7,16H,2-4,12H2,1H3,(H2,13,17)(H,14,19)(H,15,18)(H,20,21)/t5-,6-,7-/m0/s1 |
| SMILES | C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCC(N)=O)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C11H20N4O6/c1-5(11(20)21)14-10(19)7(4-16)15-9(18)6(12)2-3-8(13)17/h5-7,16H,2-4,12H2,1H3,(H2,13,17)(H,14,19)(H,15,18)(H,20,21)/t5-,6-,7-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C@@H:5]([C:11](=[O:20])[OH:21])[N:14]=[C:10]([C@H:7]([CH2:4][OH:16])[N:15]=[C:9]([C@H:6]([CH2:2][CH2:3][C:8](=[NH:13])[OH:17])[NH2:12])[OH:18])[OH:19] |
|