Cefclidin
[CAS# 105239-91-6]

Identification

• Name: Cefclidin
• Synonyms: (6R,7R)-7-[[(2Z)-2-(5-Amino-1,2,4-Thiadiazol-3-Yl)-2-Methoxyimino-Acetyl]Amino]-3-[(4-Carbamoylquinuclidin-1-Ium-1-Yl)Methyl]-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylate; (6R,7R)-7-[[(2Z)-2-(5-Amino-1,2,4-Thiadiazol-3-Yl)-2-Methoxyimino-1-Oxoethyl]Amino]-3-[(4-Carbamoyl-1-Quinuclidin-1-Iumyl)Methyl]-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylate; (6R,7R)-7-[[(2Z)-2-(5-Amino-1,2,4-Thiadiazol-3-Yl)-2-Methoxyimino-Acetyl]Amino]-3-[(4-Carbamoylquinuclidin-1-Ium-1-Yl)Methyl]-8-Keto-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylate
• Molecular Formula: C₂₁H₂₆N₈O₆S₂
• Molecular Weight: 550.61
• CAS Registry Number: 105239-91-6
• SMILES: [C@@H]34N(C(=C(C[N+]12CCC(C(N)=O)(CC1)CC2)CS3)C(=O)[O-])C(=O)[C@H]4NC(C(/C5=NSC(=N5)N)=N\OC)=O
• InChI: 1S/C21H26N8O6S2/c1-35-26-11(14-25-20(23)37-27-14)15(30)24-12-16(31)28-13(18(32)33)10(9-36-17(12)28)8-29-5-2-21(3-6-29,4-7-29)19(22)34/h12,17H,2-9H2,1H3,(H5-,22,23,24,25,27,30,32,33,34)/b26-11-/t12-,17-,21?,29?/m1/s1
• InChIKey: JUVHVMCKLDZLGN-TVNFHGJBSA-N