| Properties | Image |
| MNX_ID | MNXM1125547 |
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| reference | chebi:162959 |
| formula | C13H24N4O7 |
| global charge | 0 |
| mol weight | 348.356 |
| InChIKey | BYIROAKULFFTEK-CIUDSAMLSA-N |
| InChI | InChI=1S/C13H24N4O7/c14-4-2-1-3-8(13(23)24)16-12(22)9(5-10(19)20)17-11(21)7(15)6-18/h7-9,18H,1-6,14-15H2,(H,16,22)(H,17,21)(H,19,20)(H,23,24)/t7-,8-,9-/m0/s1 |
| SMILES | NCCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CO)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C13H24N4O7/c14-4-2-1-3-8(13(23)24)16-12(22)9(5-10(19)20)17-11(21)7(15)6-18/h7-9,18H,1-6,14-15H2,(H,16,22)(H,17,21)(H,19,20)(H,23,24)/t7-,8-,9-/m0/s1 |
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| SMILES (mnx) | [CH2:1]([CH2:2][CH2:4][NH2:14])[CH2:3][C@@H:8]([C:13](=[O:23])[OH:24])[N:16]=[C:12]([C@H:9]([CH2:5][C:10](=[O:19])[OH:20])[N:17]=[C:11]([C@H:7]([CH2:6][OH:18])[NH2:15])[OH:21])[OH:22] |
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