| Properties | Image |
| MNX_ID | MNXM1121041 |
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| reference | chebi:158428 |
| formula | C14H27N3O4 |
| global charge | 0 |
| mol weight | 301.387 |
| InChIKey | MQFGXJNSUJTXDT-QSFUFRPTSA-N |
| InChI | InChI=1S/C14H27N3O4/c1-5-8(3)11(15)13(19)16-7-10(18)17-12(14(20)21)9(4)6-2/h8-9,11-12H,5-7,15H2,1-4H3,(H,16,19)(H,17,18)(H,20,21)/t8-,9-,11-,12-/m0/s1 |
| SMILES | CC[C@H](C)[C@H](N)C(=O)NCC(=O)N[C@H](C(=O)O)[C@@H](C)CC |
MNX internals
| InChI (mnx) | InChI=1/C14H27N3O4/c1-5-8(3)11(15)13(19)16-7-10(18)17-12(14(20)21)9(4)6-2/h8-9,11-12H,5-7,15H2,1-4H3,(H,16,19)(H,17,18)(H,20,21)/t8-,9-,11-,12-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:5][C@H:8]([CH3:3])[C@@H:11]([C:13](=[N:16][CH2:7][C:10](=[N:17][C@@H:12]([C@@H:9]([CH3:4])[CH2:6][CH3:2])[C:14](=[O:20])[OH:21])[OH:18])[OH:19])[NH2:15] |
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