| Properties | Image |
| MNX_ID | MNXM1122702 |
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| reference | chebi:160096 |
| formula | C13H24N4O6 |
| global charge | 0 |
| mol weight | 332.357 |
| InChIKey | MKJBPDLENBUHQU-CIUDSAMLSA-N |
| InChI | InChI=1S/C13H24N4O6/c1-6(2)3-8(13(22)23)16-12(21)9(5-18)17-11(20)7(14)4-10(15)19/h6-9,18H,3-5,14H2,1-2H3,(H2,15,19)(H,16,21)(H,17,20)(H,22,23)/t7-,8-,9-/m0/s1 |
| SMILES | CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(N)=O)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C13H24N4O6/c1-6(2)3-8(13(22)23)16-12(21)9(5-18)17-11(20)7(14)4-10(15)19/h6-9,18H,3-5,14H2,1-2H3,(H2,15,19)(H,16,21)(H,17,20)(H,22,23)/t7-,8-,9-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH:6]([CH3:2])[CH2:3][C@@H:8]([C:13](=[O:22])[OH:23])[N:16]=[C:12]([C@H:9]([CH2:5][OH:18])[N:17]=[C:11]([C@H:7]([CH2:4][C:10](=[NH:15])[OH:19])[NH2:14])[OH:20])[OH:21] |
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