1-{3-[(3,3-dimethyloxiran-2-yl)methyl]-1H-indol-5-yl}-3-methylbut-2-en-1-one

AlkaPlorer ID: AK265357

Synonym: None

IUPAC Name: 1-[3-[(3,3-dimethyloxiran-2-yl)methyl]-1H-indol-5-yl]-3-methylbut-2-en-1-one

Structure

SMILES: CC(C)=CC(=O)C1=CC=C2NC=C(CC3OC3(C)C)C2=C1

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InChI: InChI=1S/C18H21NO2/c1-11(2)7-16(20)12-5-6-15-14(8-12)13(10-19-15)9-17-18(3,4)21-17/h5-8,10,17,19H,9H2,1-4H3

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InChIKey: DGBKCUMWSZGGMZ-UHFFFAOYSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Isolona congolana Isolona Annonaceae Magnoliales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 283.371

TPSA: 45.39

MolLogP: 4.036700000000002

Number of H-Donors: 1

Number of H-Acceptors: 2

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information