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61-24-5

61-24-5 Structure

61-24-5 Structure
IdentificationBack Directory
[Name]

7-(5-amino-5-carboxyvaleramido)cephalosporanic acid
[CAS]

61-24-5
[Synonyms]

C00916
CAPHALOSPORIN C
Cefodizime impurity 16
Cephalosporin C (7-ACA)
Cephalosporin Impurity C
Aminoadipyl cephalosporin
HOKIDJSKDBPKTQ-GLXFQSAKSA-N
Cephalosporins-intermediate II
Cefazedone sodium salt Impurity 2
7-(5-amino-5-carboxyvaleramido)cephalosporanic acid
7-(5-amino-5-carboxyvaleramido)cephalosporanic acid USP/EP/BP
(7R)-3-[(Acetyloxy)methyl]-7-[[(R)-5-carboxy-5-amino-1-oxopentyl)amino]cepham-3-ene-4-carboxylic acid
(7R)-3-[(Acetyloxy)methyl]-7-[[(R)-5-carboxy-5-amino-1-oxopentyl]amino]cepham-3-ene-4-carboxylic acid
7-(D-5-Amino-5-carboxyvaleramido)-3-(hydrox-ymethyl)-8-oxo-5-thia-1-azabicyclo[4,2,0]oct-2-ene-2-Carboxylic acid acetate
(6R,7R)-3-(acetoxymethyl)-7-((R)-5-amino-5-carboxypentanamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
5-Thia-1-azabicyclo4.2.0oct-2-ene-2-carboxylic acid, 3-(acetyloxy)methyl-7-(5R)-5-amino-5-carboxy-1-oxopentylamino-8-oxo-, (6R,7R)-
[EINECS(EC#)]

200-501-6
[Molecular Formula]

C16H21N3O8S
[MDL Number]

MFCD01682044
[MOL File]

61-24-5.mol
[Molecular Weight]

415.418
Chemical PropertiesBack Directory
[Boiling point ]

814.7±65.0 °C(Predicted)
[density ]

1.55±0.1 g/cm3(Predicted)
[pka]

2.49±0.24(Predicted)
[Optical Rotation]

+10320 (H2O)
[InChIKey]

HOKIDJSKDBPKTQ-GLXFQSAKSA-N
[SMILES]

N12[C@@]([H])([C@H](NC(=O)CCC[C@@H](N)C(O)=O)C1=O)SCC(COC(C)=O)=C2C(O)=O
Safety DataBack Directory
[Symbol(GHS) ]

GHS hazard pictograms
GHS08
[Signal word ]

Warning
[Hazard statements ]

H361
[Precautionary statements ]

P201-P202-P281-P308+P313-P405-P501
Raw materials And Preparation ProductsBack Directory
[Preparation Products]

7-Aminocephalosporanic acid-->Cefotaxime-->Cephalothin sodium-->Cefazolin-->7-Amino-3-[(5-methyl-1,3,4-thiadiazol-2-ylthio)methyl]-3-cephem-4-carboxylic Acid-->(6R-trans)-3-(acetoxymethyl)-8-oxo-7-(1H-tetrazol-1-ylacetamido)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid-->deacetoxycephalosporin C
Hazard InformationBack Directory
[Chemical Properties]

Its sodium salt dihydrate is a monoclinic crystal. It is soluble in water but insoluble in ethanol and ether. It is stable when the aqueous solution has a pH of 2.5-8.
[Definition]

ChEBI: A cephalosporin antibiotic carrying a 3-acetoxymethyl substituent and a 6-oxo-N6-L-lysino group at position 7.
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