| Properties | Image |
| MNX_ID | MNXM1122536 |
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| reference | chebi:159930 |
| formula | C12H23N5O5 |
| global charge | 0 |
| mol weight | 317.346 |
| InChIKey | NYGILGUOUOXGMJ-YUMQZZPRSA-N |
| InChI | InChI=1S/C12H23N5O5/c13-4-2-1-3-8(12(22)16-6-10(19)20)17-11(21)7(14)5-9(15)18/h7-8H,1-6,13-14H2,(H2,15,18)(H,16,22)(H,17,21)(H,19,20)/t7-,8-/m0/s1 |
| SMILES | NCCCC[C@H](NC(=O)[C@@H](N)CC(N)=O)C(=O)NCC(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C12H23N5O5/c13-4-2-1-3-8(12(22)16-6-10(19)20)17-11(21)7(14)5-9(15)18/h7-8H,1-6,13-14H2,(H2,15,18)(H,16,22)(H,17,21)(H,19,20)/t7-,8-/m0/s1 |
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| SMILES (mnx) | [CH2:1]([CH2:2][CH2:4][NH2:13])[CH2:3][C@@H:8]([C:12](=[N:16][CH2:6][C:10](=[O:19])[OH:20])[OH:22])[N:17]=[C:11]([C@H:7]([CH2:5][C:9](=[NH:15])[OH:18])[NH2:14])[OH:21] |
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