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ChEBI
> Main
CHEBI:83846 - (
S
)-pefurazoate
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ChEBI Name
(
S
)-pefurazoate
ChEBI ID
CHEBI:83846
ChEBI ASCII Name
(S)-pefurazoate
Definition
A pent-4-en-1-yl 2-[(2-furylmethyl)(imidazol-1-ylcarbonyl)amino]butanoate that is the (
S
)-enantiomer of pefurazoate.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C18H23N3O4
Net Charge
0
Average Mass
345.39290
Monoisotopic Mass
345.16886
InChI
InChI=1S/C18H23N3O4/c1-
3-
5-
6-
11-
25-
17(22)
16(4-
2)
21(13-
15-
8-
7-
12-
24-
15)
18(23)
20-
10-
9-
19-
14-
20/h3,7-
10,12,14,16H,1,4-
6,11,13H2,2H3/t16-
/m0/s1
InChIKey
WBTYBAGIHOISOQ-INIZCTEOSA-N
SMILES
CC[C@H](N(Cc1ccco1)C(=O)n1ccnc1)C(=O)OCCCC=C
ChEBI Ontology
Outgoing
(
S
)-pefurazoate (
CHEBI:83846
)
is a
pent-4-en-1-yl 2-[(2-furylmethyl)(imidazol-1-ylcarbonyl)amino]butanoate (
CHEBI:83845
)
(
S
)-pefurazoate (
CHEBI:83846
)
is enantiomer of
(
R
)-pefurazoate (
CHEBI:83847
)
Incoming
pefurazoate (
CHEBI:81775
)
has part
(
S
)-pefurazoate (
CHEBI:83846
)
(
R
)-pefurazoate (
CHEBI:83847
)
is enantiomer of
(
S
)-pefurazoate (
CHEBI:83846
)
IUPAC Name
pent-4-en-1-yl (2
S
)-2-[(2-furylmethyl)(1
H
-imidazol-1-ylcarbonyl)amino]butanoate
Last Modified
21 November 2014