Cinereapyrrole A

AlkaPlorer ID: AK055992

Synonym: '', 'Cinereapyrrole A'

IUPAC Name: methyl 3,4-bis(5-hydroxy-1H-indol-3-yl)-1H-pyrrole-2-carboxylate

Structure

SMILES: COC(=O)C1=C(C2=CNC3=CC=C(O)C=C23)C(C2=CNC3=CC=C(O)C=C23)=CN1

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InChI: InChI=1S/C22H17N3O4/c1-29-22(28)21-20(16-9-24-19-5-3-12(27)7-14(16)19)17(10-25-21)15-8-23-18-4-2-11(26)6-13(15)18/h2-10,23-27H,1H3

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InChIKey: BNSOXMYZQBRSHQ-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 387.395

TPSA: 114.13000000000002

MolLogP: 4.509100000000003

Number of H-Donors: 5

Number of H-Acceptors: 4

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information