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> Main
CHEBI:77454 - dextrobupivacaine hydrochloride hydrate
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ChEBI Name
dextrobupivacaine hydrochloride hydrate
ChEBI ID
CHEBI:77454
Definition
The monohydrate form of dextrobupivacaine hydrochloride.
Stars
This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Molfile
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Molfile
Formula
C18H31ClN2O2
Net Charge
0
Average Mass
342.90400
Monoisotopic Mass
342.20741
InChI
InChI=1S/C18H28N2O.ClH.H2O/c1-
4-
5-
12-
20-
13-
7-
6-
11-
16(20)
18(21)
19-
17-
14(2)
9-
8-
10-
15(17)
3;;/h8-
10,16H,4-
7,11-
13H2,1-
3H3,(H,19,21)
;1H;1H2/t16-
;;/m1../s1
InChIKey
HUCIWBPMHXGLFM-GGMCWBHBSA-N
SMILES
O.Cl.CCCCN1CCCC[C@@H]1C(=O)Nc1c(C)cccc1C
ChEBI Ontology
Outgoing
dextrobupivacaine hydrochloride hydrate (
CHEBI:77454
)
has part
dextrobupivacaine hydrochloride (anhydrous) (
CHEBI:77442
)
dextrobupivacaine hydrochloride hydrate (
CHEBI:77454
)
is a
1-butyl-
N
-(2,6-dimethylphenyl)piperidine-2-carboxamide hydrochloride hydrate (
CHEBI:77449
)
dextrobupivacaine hydrochloride hydrate (
CHEBI:77454
)
is enantiomer of
levobupivacaine hydrochloride hydrate (
CHEBI:77453
)
Incoming
bupivacaine hydrochloride hydrate (
CHEBI:60789
)
has part
dextrobupivacaine hydrochloride hydrate (
CHEBI:77454
)
levobupivacaine hydrochloride hydrate (
CHEBI:77453
)
is enantiomer of
dextrobupivacaine hydrochloride hydrate (
CHEBI:77454
)
IUPAC Names
(2
R
)-1-butyl-2-[(2,6-dimethylphenyl)carbamoyl]piperidinium chloride—water (1/1)
(2
R
)-
1-
butyl-
N
-
(2,6-
dimethylphenyl)piperidine-
2-
carboxamide hydrochloride—water (1/1)
Synonyms
Sources
(
R
)-1-butyl-2',6'-pipecoloxylidide hydrochloride hydrate
ChEBI
dextrobupivacaine hydrochloride monohydrate
ChEBI
dextrobupivacaine monohydrochloride monohydrate
ChEBI
dextrobupivacaine.HCl.H
2
O
ChEBI
Last Modified
24 February 2014