| Properties | Image |
| MNX_ID | MNXM1124908 |
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| reference | chebi:162315 |
| formula | C13H23N3O4 |
| global charge | 0 |
| mol weight | 285.344 |
| InChIKey | FEPSEIDIPBMIOS-QXEWZRGKSA-N |
| InChI | InChI=1S/C13H23N3O4/c1-3-8(2)11(13(19)20)16-10(17)7-15-12(18)9-5-4-6-14-9/h8-9,11,14H,3-7H2,1-2H3,(H,15,18)(H,16,17)(H,19,20)/t8-,9-,11-/m0/s1 |
| SMILES | CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C13H23N3O4/c1-3-8(2)11(13(19)20)16-10(17)7-15-12(18)9-5-4-6-14-9/h8-9,11,14H,3-7H2,1-2H3,(H,15,18)(H,16,17)(H,19,20)/t8-,9-,11-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][C@H:8]([CH3:2])[C@@H:11]([C:13](=[O:19])[OH:20])[N:16]=[C:10]([CH2:7][N:15]=[C:12]([C@@H:9]1[CH2:5][CH2:4][CH2:6][NH:14]1)[OH:18])[OH:17] |
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