2-(1H-indol-3-yl)ethyl (9E,12E)-octadeca-9,12-dienoate

AlkaPlorer ID: AK228731

Synonym: None

IUPAC Name: 2-(1H-indol-3-yl)ethyl octadeca-9,12-dienoate

Structure

SMILES: CCCCCC=CCC=CCCCCCCCC(=O)OCCC1=CNC2=CC=CC=C12

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InChI: InChI=1S/C28H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-28(30)31-23-22-25-24-29-27-20-18-17-19-26(25)27/h6-7,9-10,17-20,24,29H,2-5,8,11-16,21-23H2,1H3

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InChIKey: IFIHQODEQMQNRX-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 423.6410000000001

TPSA: 42.09

MolLogP: 8.067100000000007

Number of H-Donors: 1

Number of H-Acceptors: 2

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information