CAS Registry Number®
98753-19-6
CAS Name
Cefpirome sulfate
Molecular Formula
C22H23N6O5S2.HO4S
Compound Properties
-
Melting Point (1)
>200 °C
Source(s)
- (1) Duan, Xuemin; Synthetic Communications, (2011), 41(5), 629-636, CAplus
Other Names and Identifiers
InChI
InChI=1S/C22H22N6O5S2.H2O4S/c1-33-26-15(13-10-35-22(23)24-13)18(29)25-16-19(30)28-17(21(31)32)12(9-34-20(16)28)8-27-7-3-5-11-4-2-6-14(11)27;1-5(2,3)4/h3,5,7,10,16,20H,2,4,6,8-9H2,1H3,(H3-,23,24,25,29,31,32);(H2,1,2,3,4)/b26-15-;/t16-,20-;/m1./s1
InChIKey
InChIKey=RKTNPKZEPLCLSF-QHBKFCFHSA-N
SMILES
C(O)(=O)C=1N2[C@@]([C@H](NC(/C(=N\OC)/C3=CSC(N)=N3)=O)C2=O)(SCC1C[N+]4=C5C(CCC5)=CC=C4)[H].S(=O)(=O)([O-])O
Canonical SMILES
O=C(O)C1=C(CSC2N1C(=O)C2NC(=O)C(=NOC)C=3N=C(SC3)N)C[N+]=4C=CC=C5C4CCC5.O=S(=O)([O-])O
Other Names for this Substance
- 5H-Cyclopenta[b]pyridinium, 1-[[(6R,7R)-7-[[(2Z)-(2-amino-4-thiazolyl)(methoxyimino)acetyl]amino]-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl]-6,7-dihydro-, sulfate (1:1)
- HR 810 sulfate
- Cefpirome sulfate
- Keiten
- Broact
Deleted or Replaced CAS Registry Numbers
128401-54-7, 92682-19-4, 160888-38-0
