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ChEBI
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CHEBI:50897 - cefalotin(1−)
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ChEBI Name
cefalotin(1−)
ChEBI ID
CHEBI:50897
ChEBI ASCII Name
cefalotin(1-)
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C16H15N2O6S2
Net Charge
-1
Average Mass
395.43218
Monoisotopic Mass
395.03770
InChI
InChI=1S/C16H16N2O6S2/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)
/p-
1/t12-
,15-
/m1/s1
InChIKey
XIURVHNZVLADCM-IUODEOHRSA-M
SMILES
[H][C@@]1(NC(=O)Cc2cccs2)C(=O)N2C(C([O-])=O)=C(COC(C)=O)CS[C@]12[H]
ChEBI Ontology
Outgoing
cefalotin(1−) (
CHEBI:50897
)
is a
carboxylic acid anion (
CHEBI:29067
)
cefalotin(1−) (
CHEBI:50897
)
is conjugate base of
cefalotin (
CHEBI:124991
)
Incoming
cefalotin (
CHEBI:124991
)
is conjugate acid of
cefalotin(1−) (
CHEBI:50897
)
Registry Number
Type
Source
4165215
Beilstein Registry Number
Beilstein
Last Modified
18 December 2008