| Properties | Image |
| MNX_ID | MNXM128302 |
 |
| reference | chebi:72492 |
| formula | C12H17N5O5 |
| global charge | 0 |
| mol weight | 311.298 |
| InChIKey | RTUBWEYSVHBUFM-VIFPVBQESA-N |
| InChI | InChI=1S/C12H17N5O5/c13-9(12(14)18)3-1-2-6-15-10-5-4-8(16(19)20)7-11(10)17(21)22/h4-5,7,9,15H,1-3,6,13H2,(H2,14,18)/t9-/m0/s1 |
| SMILES | NC(=O)[C@@H](N)CCCCNC1=CC=C([N+](=O)[O-])C=C1[N+](=O)[O-] |
MNX internals
| InChI (mnx) | InChI=1/C12H17N5O5/c13-9(12(14)18)3-1-2-6-15-10-5-4-8(16(19)20)7-11(10)17(21)22/h4-5,7,9,15H,1-3,6,13H2,(H2,14,18)/t9-/m0/s1 |
 |
| SMILES (mnx) | [CH2:1]([CH2:2][CH2:6][NH:15][C:10]1=[C:11]([N+:17]([O-:21])=[O:22])[CH:7]=[C:8]([N+:16]([O-:19])=[O:20])[CH:4]=[CH:5]1)[CH2:3][C@@H:9]([C:12](=[NH:14])[OH:18])[NH2:13] |
|