| Properties | Image |
| MNX_ID | MNXM1126100 |
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| reference | chebi:163514 |
| formula | C9H16N4O6 |
| global charge | 0 |
| mol weight | 276.249 |
| InChIKey | XCLCVBYNGXEVDU-WHFBIAKZSA-N |
| InChI | InChI=1S/C9H16N4O6/c10-2-7(16)12-4(1-6(11)15)8(17)13-5(3-14)9(18)19/h4-5,14H,1-3,10H2,(H2,11,15)(H,12,16)(H,13,17)(H,18,19)/t4-,5-/m0/s1 |
| SMILES | NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C9H16N4O6/c10-2-7(16)12-4(1-6(11)15)8(17)13-5(3-14)9(18)19/h4-5,14H,1-3,10H2,(H2,11,15)(H,12,16)(H,13,17)(H,18,19)/t4-,5-/m0/s1 |
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| SMILES (mnx) | [CH2:1]([C@@H:4]([C:8](=[N:13][C@@H:5]([CH2:3][OH:14])[C:9](=[O:18])[OH:19])[OH:17])[N:12]=[C:7]([CH2:2][NH2:10])[OH:16])[C:6](=[NH:11])[OH:15] |
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