| Properties | Image |
|---|
| MNX_ID | MNXM1126204 |
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| reference | chebi:163618 |
| formula | C11H20N4O6 |
| global charge | 0 |
| mol weight | 304.303 |
| InChIKey | DFTCYYILCSQGIZ-GCJQMDKQSA-N |
| InChI | InChI=1S/C11H20N4O6/c1-4(14-10(19)8(13)5(2)16)9(18)15-6(11(20)21)3-7(12)17/h4-6,8,16H,3,13H2,1-2H3,(H2,12,17)(H,14,19)(H,15,18)(H,20,21)/t4-,5+,6-,8-/m0/s1 |
| SMILES | C[C@H](NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C11H20N4O6/c1-4(14-10(19)8(13)5(2)16)9(18)15-6(11(20)21)3-7(12)17/h4-6,8,16H,3,13H2,1-2H3,(H2,12,17)(H,14,19)(H,15,18)(H,20,21)/t4-,5+,6-,8-/m0/s1 |
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| SMILES (mnx) | [CH3:1][C@@H:4]([C:9](=[N:15][C@@H:6]([CH2:3][C:7](=[NH:12])[OH:17])[C:11](=[O:20])[OH:21])[OH:18])[N:14]=[C:10]([C@H:8]([C@@H:5]([CH3:2])[OH:16])[NH2:13])[OH:19] |
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