Cefclidin

CAS Registry Number®

105239-91-6

CAS Name

Cefclidin

Molecular Formula

C21H26N8O6S2

Cite this Page

Cefclidin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=105239-91-6 (retrieved 2024-11-25) (CAS RN: 105239-91-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

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

InChIKey=JUVHVMCKLDZLGN-TVNFHGJBSA-N

SMILES

C([O-])(=O)C=1N2[C@@]([C@H](NC(/C(=N\OC)/C=3N=C(N)SN3)=O)C2=O)(SCC1C[N+]45CCC(C(N)=O)(CC4)CC5)[H]

Canonical SMILES

O=C([O-])C1=C(CSC2N1C(=O)C2NC(=O)C(=NOC)C3=NSC(=N3)N)C[N+]45CCC(C(=O)N)(CC4)CC5

Other Names for this Substance

  • 1-Azoniabicyclo[2.2.2]octane, 4-(aminocarbonyl)-1-[[(6R,7R)-7-[[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(methoxyimino)acetyl]amino]-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl]-, inner salt
  • 1-Azoniabicyclo[2.2.2]octane, 4-(aminocarbonyl)-1-[[7-[[(5-amino-1,2,4-thiadiazol-3-yl)(methoxyimino)acetyl]amino]-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl]-, inner salt, [6R-[6α,7β(Z)]]-
  • 1-Azoniabicyclo[2.2.2]octane, 4-(aminocarbonyl)-1-[[(6R,7R)-7-[[(2Z)-(5-amino-1,2,4-thiadiazol-3-yl)(methoxyimino)acetyl]amino]-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl]-, inner salt
  • 1,2,4-Thiadiazole, 1-azoniabicyclo[2.2.2]octane deriv.
  • E 1040 (antibiotic)

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