| Properties | Image |
| MNX_ID | MNXM1126836 |
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| reference | chebi:164253 |
| formula | C13H24N4O7 |
| global charge | 0 |
| mol weight | 348.356 |
| InChIKey | MFMGPEKYBXFIRF-SUSMZKCASA-N |
| InChI | InChI=1S/C13H24N4O7/c1-5(18)9(15)11(21)17-10(6(2)19)12(22)16-7(13(23)24)3-4-8(14)20/h5-7,9-10,18-19H,3-4,15H2,1-2H3,(H2,14,20)(H,16,22)(H,17,21)(H,23,24)/t5-,6-,7+,9+,10+/m1/s1 |
| SMILES | C[C@@H](O)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O |
MNX internals
| InChI (mnx) | InChI=1/C13H24N4O7/c1-5(18)9(15)11(21)17-10(6(2)19)12(22)16-7(13(23)24)3-4-8(14)20/h5-7,9-10,18-19H,3-4,15H2,1-2H3,(H2,14,20)(H,16,22)(H,17,21)(H,23,24)/t5-,6-,7+,9+,10+/m1/s1 |
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| SMILES (mnx) | [CH3:1][C@H:5]([C@@H:9]([C:11](=[N:17][C@@H:10]([C@@H:6]([CH3:2])[OH:19])[C:12](=[N:16][C@@H:7]([CH2:3][CH2:4][C:8](=[NH:14])[OH:20])[C:13](=[O:23])[OH:24])[OH:22])[OH:21])[NH2:15])[OH:18] |
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