 |
| Ligand Name: FLOMOX |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB820 |
PubChem:
5282438
|
Synonym(s):
- cefcapene pivoxil
- 105889-45-0
- cefcapene piroxil
- cefcapene-pivoxil
- unii-8i8mj56xfq
- 8i8mj56xfq
- 2,2-dimethylpropanoyloxymethyl (6r,7r)-7-[[(z)-2-(2-amino-1,3-thiazol-4-yl)pent-2-enoyl]amino]-3-(carbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
- s-1108
- cefcamate pivoxil
- c23h29n5o8s2
- pubchem13764
- schembl155121
- schembl155122
- chembl2431072
- dtxsid7049134
- zinc3924558
- cc0250
- akos015841961
- akos015896113
- as-12938
- c13141
- 889c450
- a801331
- q27270575
- (6r,7r)-7-[[(z)-2-(2-amino-4-thiazolyl)-1-oxopent-2-enyl]amino]-3-(carbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (2,2-dimethyl-1-oxopropoxy)methyl ester
- 2,2-dimethylpropanoyloxymethyl (6r,7r)-3-(aminocarbonyloxymethyl)-7-[[(z)-2-(2-azanyl-1,3-thiazol-4-yl)pent-2-enoyl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
- 5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3-(((aminocarbonyl)oxy)methyl)-7-(((2z)-2-(2-amino-4-thiazolyl)-1-oxo-2-pentenyl)amino)-8-oxo-, (2,2-dimethyl-1-oxopropoxy)methyl ester, (6r,7r)-
- 5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3-(((aminocarbonyl)oxy)methyl)-7-((2-(2-amino-4-thiazolyl)-1-oxo-2-pentenyl)amino)-8-oxo-, (2,2-dimethyl-1-oxopropoxy)methyl ester, (6r-(6alpha,7beta(z)))-
show 27 synonym(s)
|
| DrugBank: - |
ChEMBL: CHEMBL2431072 |
| Canonical SMILES: Nc1nc(cs1)/C(=C/CC)C(=O)N[C@H](C2=O)[C@H](N23)SCC(COC(=O)N)=C3C(=O)OCOC(=O)C(C)(C)C |
| Standard InChI: InChI=1S/C23H29N5O8S2/c1-5-6-12(13-9-38-21(24)26-13)16(29)27-14-17(30)28-15(11(7-34-22(25)33)8-37-18(14)28)19(31)35-10-36-20(32)23(2,3)4/h6,9,14,18H,5,7-8,10H2,1-4H3,(H2,24,26)(H2,25,33)(H,27,29)/b12-6-/t14-,18-/m1/s1 |
| Molecular Formula: C23H29N5O8S2 |
Mol. Weight: 567.14575 |
logP: 1.358 |
| HBD: 3 | HBA: 12 |
| #Rotatable Bonds: 9 | TPSA: 193.24 |