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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:3542 - cephalothin sodium
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ChEBI Name
cephalothin sodium
ChEBI ID
CHEBI:3542
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C16H15N2O6S2.Na
Net Charge
0
Average Mass
418.42195
Monoisotopic Mass
418.02692
InChI
InChI=1S/C16H16N2O6S2.Na/c1-
8(19)
24-
6-
9-
7-
26-
15-
12(14(21)
18(15)
13(9)
16(22)
23)
17-
11(20)
5-
10-
3-
2-
4-
25-
10;/h2-
4,12,15H,5-
7H2,1H3,(H,17,20)
(H,22,23)
;/q;+1/p-
1/t12-
,15-
;/m1./s1
InChIKey
VUFGUVLLDPOSBC-XRZFDKQNSA-M
SMILES
[Na+].[H][C@@]1(NC(=O)Cc2cccs2)C(=O)N2C(C([O-])=O)=C(COC(C)=O)CS[C@]12[H]
ChEBI Ontology
Outgoing
cephalothin sodium (
CHEBI:3542
)
has part
cefalotin (
CHEBI:124991
)
cephalothin sodium (
CHEBI:3542
)
is a
organic sodium salt (
CHEBI:38700
)
IUPAC Name
sodium (6
R
,7
R
)-
3-
(acetoxymethyl)-
8-
oxo-
7-
[(2-
thienylacetyl)amino]-
5-
thia-
1-
azabicyclo[4.2.0]oct-
2-
ene-
2-
carboxylate
Synonyms
Sources
7-(Thiophene-2-acetamido)cephalosporanic acid sodium salt
ChemIDplus
Cefalotin sodium
KEGG COMPOUND
Cefalotina sódica
ChemIDplus
Cephalothin sodium
KEGG COMPOUND
Monosodium (6
R
,7
R
)-
3-
(hydroxymethyl)-
8-
oxo-
7-
(2-
(2-
thienyl)acetamido)-
5-
thia-
1-
azabicyclo(4.2.0)oct-
2-
ene-
2-
carboxylate acetate
ChemIDplus
Sodium cefalotin
ChemIDplus
Sodium cephalothin
ChemIDplus
Sodium cephalotin
ChemIDplus
Manual Xrefs
Databases
C08100
KEGG COMPOUND
D00907
KEGG DRUG
DB00456
DrugBank
View more database links
Registry Numbers
Types
Sources
4120707
Beilstein Registry Number
Beilstein
58-71-9
CAS Registry Number
ChemIDplus
Last Modified
02 December 2009