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| Ligand ID | EF8 |
| InChI | InChI=1S/C19H36N5O5P/c1-4-15(5-2)29-18-13-16(12-17(20)19(18)23-14(3)25)30(26,27)28-11-9-7-6-8-10-22-24-21/h13,15,17-19,21H,4-12,20H2,1-3H3,(H-,23,25,26,27)/p+1/t17-,18+,19+/m0/s1 |
| InChIKey | SQYBSQHYIJSZEH-IPMKNSEASA-O |
| SMILES | | Software | SMILES |
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| OpenEye OEToolkits 2.0.6 | CCC(CC)OC1C=C(CC(C1NC(=O)C)N)P(=O)(O)OCCCCCCN=[N+]=N | | OpenEye OEToolkits 2.0.6 | CCC(CC)O[C@@H]1C=C(C[C@@H]([C@H]1NC(=O)C)N)P(=O)(O)OCCCCCCN=[N+]=N | | CACTVS 3.385 | CCC(CC)O[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)[P](O)(=O)OCCCCCCN=[N+]=N | | CACTVS 3.385 | CCC(CC)O[CH]1C=C(C[CH](N)[CH]1NC(C)=O)[P](O)(=O)OCCCCCCN=[N+]=N |
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| Formula | C19 H37 N5 O5 P |
| Name | 6-[[(3~{R},4~{R},5~{S})-4-acetamido-5-azanyl-3-pentan-3-yloxy-cyclohexen-1-yl]-oxidanyl-phosphoryl]oxyhexylimino-azanylidene-azanium |
| ChEMBL | |
| DrugBank | |
| ZINC |
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| PDB chain | 6g02 Chain A Residue 502
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