| Properties | Image |
| MNX_ID | MNXM1198202 |
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| reference | envipathM:...c51261325d8d |
| formula | C12H19N4O5 |
| global charge | -1 |
| mol weight | 299.307 |
| InChIKey | ODXRLAGTXYVKIJ-HTRCEHHLSA-M |
| InChI | InChI=1S/C12H20N4O5/c1-6(10(14)18)15-11(19)7(2)16(3)9(17)5-4-8(13)12(20)21/h6,8H,2,4-5,13H2,1,3H3,(H2,14,18)(H,15,19)(H,20,21)/p-1/t6-,8-/m1/s1 |
| SMILES | C=C(C(=O)N[C@H](C)C(N)=O)N(C)C(=O)CC[C@@H](N)C(=O)[O-] |
MNX internals
| InChI (mnx) | InChI=1/C12H20N4O5/c1-6(10(14)18)15-11(19)7(2)16(3)9(17)5-4-8(13)12(20)21/h6,8H,2,4-5,13H2,1,3H3,(H2,14,18)(H,15,19)(H,20,21)/t6-,8-/m1/s1 |
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| SMILES (mnx) | [CH3:1][C@H:6]([C:10](=[NH:14])[OH:18])[N:15]=[C:11]([C:7](=[CH2:2])[N:16]([CH3:3])[C:9]([CH2:5][CH2:4][C@H:8]([C:12](=[O:20])[OH:21])[NH2:13])=[O:17])[OH:19] |
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