Choline; 3-(4-Hydroxyphenyl)propanoyl

AlkaPlorer ID: AK223618

Synonym: 3-(4-Hydroxyphenyl)propanoylcholine

IUPAC Name: 2-[3-(4-hydroxyphenyl)propanoyloxy]ethyl-trimethylazanium

Structure

SMILES: C[N+](C)(C)CCOC(=O)CCC1=CC=C(O)C=C1

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InChI: InChI=1S/C14H21NO3/c1-15(2,3)10-11-18-14(17)9-6-12-4-7-13(16)8-5-12/h4-5,7-8H,6,9-11H2,1-3H3/p+1

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InChIKey: INXZMKYRESEZON-UHFFFAOYSA-O

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Reference

PubChem CID: 11218962

SuperNatural Ⅲ: SN0150601

COCONUT: CNP0072798

Source

Species Genus Family Order Class Phylum Kingdom Domain
Polyscias murrayi Polyscias Araliaceae Apiales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 252.334

TPSA: 46.53

MolLogP: 1.5741999999999998

Number of H-Donors: 1

Number of H-Acceptors: 3

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information