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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:60654 - valproate
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ChEBI Ontology
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ChEBI Name
valproate
ChEBI ID
CHEBI:60654
Definition
A branched-chain saturated fatty acid anion that is the conjugate base of valproic acid.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:68615
Supplier Information
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Molfile
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Molfile
Formulae
C8H15O2
C8H15O2
Net Charge
-1
Average Mass
143.20350
Monoisotopic Mass
143.10775
InChI
InChI=1S/C8H16O2/c1-3-5-7(6-4-2)8(9)10/h7H,3-6H2,1-2H3,(H,9,10)/p-1
InChIKey
NIJJYAXOARWZEE-UHFFFAOYSA-M
SMILES
CCCC(CCC)C([O-])=O
Roles Classification
Application
(s):
antimanic drug
Antimanic drugs are agents used to treat bipolar disorders or mania associated with other affective disorders.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
valproate (
CHEBI:60654
)
has functional parent
valerate (
CHEBI:31011
)
valproate (
CHEBI:60654
)
has role
antimanic drug (
CHEBI:35477
)
valproate (
CHEBI:60654
)
is a
branched-chain saturated fatty acid anion (
CHEBI:58956
)
valproate (
CHEBI:60654
)
is conjugate base of
valproic acid (
CHEBI:39867
)
Incoming
valproyl-CoA(4−) (
CHEBI:156457
)
has functional parent
valproate (
CHEBI:60654
)
sodium valproate (
CHEBI:9925
)
has part
valproate (
CHEBI:60654
)
valproic acid (
CHEBI:39867
)
is conjugate acid of
valproate (
CHEBI:60654
)
IUPAC Name
2-propylpentanoate
Synonyms
Sources
2-propylvalerate
ChEBI
dipropylacetate
ChEBI
Manual Xref
Database
LSM-6363
LINCS
View more database links
Citations
Types
Sources
16012283
PubMed citation
Europe PMC
20633966
PubMed citation
Europe PMC
21161183
PubMed citation
Europe PMC
21167688
PubMed citation
Europe PMC
21243535
PubMed citation
Europe PMC
21454832
PubMed citation
Europe PMC
21459656
PubMed citation
Europe PMC
21472635
PubMed citation
Europe PMC
21593515
PubMed citation
Europe PMC
21629819
PubMed citation
Europe PMC
21767635
PubMed citation
Europe PMC
8681902
PubMed citation
Europe PMC
Last Modified
25 February 2016