3-{1-[2-(4-hydroxyphenyl)ethyl]-3-propylpyrrolidin-3-yl}phenol

AlkaPlorer ID: AK087880

Synonym: None

IUPAC Name: 3-[1-[2-(4-hydroxyphenyl)ethyl]-3-propylpyrrolidin-3-yl]phenol

Structure

SMILES: CCCC1(C2=CC=CC(O)=C2)CCN(CCC2=CC=C(O)C=C2)C1

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InChI: InChI=1S/C21H27NO2/c1-2-11-21(18-4-3-5-20(24)15-18)12-14-22(16-21)13-10-17-6-8-19(23)9-7-17/h3-9,15,23-24H,2,10-14,16H2,1H3

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InChIKey: LRMYMYHAGWQOEO-UHFFFAOYSA-N

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Reference

PubChem CID: 119611

CAS: 27544-75-8

NPASS: NPC67373

COCONUT: CNP0085861

Source

Species Genus Family Order Class Phylum Kingdom Domain
Ligustrum lucidum Ligustrum Oleaceae Lamiales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 325.452

TPSA: 43.7

MolLogP: 4.084100000000003

Number of H-Donors: 2

Number of H-Acceptors: 3

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information