3-{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}propanoic acid
CHEBI:CHEBI_143310
Definition
A carboxylic acid that is 3-phenylpropanoic acid substituted at position 4 by a 2-hydroxy-3-(propan-2-ylamino)propoxy group.
Chemical Information
- Molecular Formula
- C15H23NO4
- Molecular Mass
- 281.34740
- Charge
- 0
- SMILES
- CC(C)NCC(O)COc1ccc(CCC(O)=O)cc1
- InChI
- InChI=1S/C15H23NO4/c1-11(2)16-9-13(17)10-20-14-6-3-12(4-7-14)5-8-15(18)19/h3-4,6-7,11,13,16-17H,5,8-10H2,1-2H3,(H,18,19)
- InChIKey
- ILSCWPMGTDPATI-UHFFFAOYSA-N
Alternative Names
- 3-{4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl}propionic acid
- 3-{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}propanoic acid
Drug Classification
-
carboxylic acidView Class →
CHEBI:33575
-
secondary amino compoundView Class →
CHEBI:50995
-
ethanolaminesView Class →
CHEBI:23981
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:5284008
- core#notation
- CHEBI:143310
Additional References
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Additional Attributes
- oboInOwl#hasOBONamespace
- chebi_ontology
- oboInOwl#hasDbXref
- Reaxys:5284008
- oboInOwl#id
- CHEBI:143310
- core#notation
- CHEBI:143310
- oboInOwl#inSubset
- http://purl.obolibrary.org/obo/chebi#3_STAR
- 22-rdf-syntax-ns#type
- http://www.w3.org/2002/07/owl#Class
- chebi#has_functional_parent
- http://purl.obolibrary.org/obo/CHEBI_88206
- owl#annotatedSource
- t112452
- owl#someValuesFrom
- t313699