valerate
CHEBI:CHEBI_31011
Definition
A short-chain fatty acid anion that is the conjugate base of valeric acid; present in ester form as component of many steroid-based pharmaceuticals.
Chemical Information
- Molecular Formula
- C5H9O2
- Molecular Mass
- 101.12376
- Charge
- -1
- SMILES
- CCCCC([O-])=O
- InChI
- InChI=1S/C5H10O2/c1-2-3-4-5(6)7/h2-4H2,1H3,(H,6,7)/p-1
- InChIKey
- NQPDZGIKBAWPEJ-UHFFFAOYSA-M
Alternative Names
- CH3-[CH2]3-COO(-)
- n-propylacetate
- pentanoate
- pentanoate
- pentanoic acid, ion(1-)
Drug Classification
-
short-chain fatty acid anionView Class →
CHEBI:58951
-
t175401
-
t175657
Important Medical Information
⚕️ This information is sourced from ChEBI (Chemical Entities of Biological Interest) database and is intended for educational purposes only.
- Always consult with a healthcare professional before starting, stopping, or modifying any medication.
- Side effects may vary and this list may not be comprehensive.
- Drug interactions may occur with other medications.
Additional Identifiers
- oboInOwl#hasDbXref
- Reaxys:3903735
- core#notation
- CHEBI:31011
Additional References
🔍 Click on any linked disease name to learn more about the conditions this medication is used to treat, or explore related drug classifications for more information about similar medications.
Additional Attributes
- oboInOwl#hasOBONamespace
- chebi_ontology
- oboInOwl#hasDbXref
- Reaxys:3903735
- oboInOwl#hasAlternativeId
- CHEBI:25890
- oboInOwl#id
- CHEBI:31011
- core#notation
- CHEBI:31011
- oboInOwl#inSubset
- http://purl.obolibrary.org/obo/chebi#3_STAR
- RO_0000087
- http://purl.obolibrary.org/obo/CHEBI_76924
- chebi#is_conjugate_base_of
- http://purl.obolibrary.org/obo/CHEBI_17418
- 22-rdf-syntax-ns#type
- http://www.w3.org/2002/07/owl#Class
- chebi#has_functional_parent
- http://purl.obolibrary.org/obo/CHEBI_25798
- rdf-schema#domain
- https://w3id.org/def/predibionto#has_side_effect10122
- chebi#is_conjugate_acid_of
- http://purl.obolibrary.org/obo/CHEBI_17418
- owl#someValuesFrom
- t255942
- owl#annotatedSource
- t176732