Prodigiosin; Demethoxy

AlkaPlorer ID: AK023430

Synonym: Demethoxyprodigiosin

IUPAC Name: 2-methyl-3-pentyl-5-[[5-(1H-pyrrol-2-yl)pyrrol-2-ylidene]methyl]-1H-pyrrole

Structure

SMILES: CCCCCC1=CC(=CC2=CC=C(C3=CC=CN3)N2)N=C1C

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InChI: InChI=1S/C19H23N3/c1-3-4-5-7-15-12-17(21-14(15)2)13-16-9-10-19(22-16)18-8-6-11-20-18/h6,8-13,20,22H,3-5,7H2,1-2H3

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InChIKey: UWLOAAIZPLISDF-UHFFFAOYSA-N

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Reference

COCONUT: CNP0018673

Source

Properties Information

Molecule Weight: 293.41400000000004

TPSA: 43.94

MolLogP: 5.3319000000000045

Number of H-Donors: 2

Number of H-Acceptors: 1

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information