Pityriarubin C

AlkaPlorer ID: AK050425

Synonym: '', 'Pityriarubin C'

IUPAC Name: 3-hydroxy-4,7,8-tris(1H-indol-3-yl)-1-oxaspiro[4.4]nona-3,7-diene-2,6,9-trione

Structure

SMILES: O=C1OC2(C(=O)C(C3=CNC4=CC=CC=C34)=C(C3=CNC4=CC=CC=C34)C2=O)C(C2=CNC3=CC=CC=C23)=C1O

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InChI: InChI=1S/C32H19N3O5/c36-28-27(21-15-35-24-12-6-3-9-18(21)24)32(40-31(28)39)29(37)25(19-13-33-22-10-4-1-7-16(19)22)26(30(32)38)20-14-34-23-11-5-2-8-17(20)23/h1-15,33-36H

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InChIKey: HODDPEOUHGCZAP-UHFFFAOYSA-N

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Source

Properties Information

Molecule Weight: 525.5200000000002

TPSA: 128.04

MolLogP: 5.458000000000003

Number of H-Donors: 4

Number of H-Acceptors: 5

RingCount: 8

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information