| Properties | Image |
|---|
| MNX_ID | MNXM1124604 |
 |
| reference | chebi:162009 |
| formula | C14H22N4O7 |
| global charge | 0 |
| mol weight | 358.351 |
| InChIKey | JFSNBQJNDMXMQF-XHNCKOQMSA-N |
| InChI | InChI=1S/C14H22N4O7/c15-7(3-4-10(16)19)12(22)17-8(6-11(20)21)13(23)18-5-1-2-9(18)14(24)25/h7-9H,1-6,15H2,(H2,16,19)(H,17,22)(H,20,21)(H,24,25)/t7-,8-,9+/m0/s1 |
| SMILES | NC(=O)CC[C@H](N)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@@H]1C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C14H22N4O7/c15-7(3-4-10(16)19)12(22)17-8(6-11(20)21)13(23)18-5-1-2-9(18)14(24)25/h7-9H,1-6,15H2,(H2,16,19)(H,17,22)(H,20,21)(H,24,25)/t7-,8-,9+/m0/s1 |
 |
| SMILES (mnx) | [CH2:1]1[CH2:2][C@H:9]([C:14](=[O:24])[OH:25])[N:18]([C:13]([C@H:8]([CH2:6][C:11](=[O:20])[OH:21])[N:17]=[C:12]([C@H:7]([CH2:3][CH2:4][C:10](=[NH:16])[OH:19])[NH2:15])[OH:22])=[O:23])[CH2:5]1 |
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