Pseudodeoxyviolacein

AlkaPlorer ID: AK077788

Synonym: 3-[1,5-Dihydro-4-(1H-indol-3-yl)-5-oxo-2H-pyrrol-2-ylidene]-1,3-dihydro-2H-indol-2-one 

IUPAC Name: 3-[5-hydroxy-4-(1H-indol-3-yl)-1H-pyrrol-2-yl]indol-2-one

Structure

SMILES: O=C1NC(=C2C(=O)NC3=CC=CC=C23)C=C1C1=CNC2=CC=CC=C12

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InChI: InChI=1S/C20H13N3O2/c24-19-13(14-10-21-15-7-3-1-5-11(14)15)9-17(23-19)18-12-6-2-4-8-16(12)22-20(18)25/h1-10,21H,(H,22,25)(H,23,24)

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InChIKey: IKMJWLIQHWOSBK-UHFFFAOYSA-N

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Reference

COCONUT: CNP0390385

Properties Information

Molecule Weight: 327.3430000000001

TPSA: 73.99000000000001

MolLogP: 3.044500000000001

Number of H-Donors: 3

Number of H-Acceptors: 2

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information