6,8-dihydroxy-1-(1H-indol-3-yl)-2H,3aH,4H,5H-naphtho[2,1-b]furan-2,5-dione

AlkaPlorer ID: AK342025

Synonym: None

IUPAC Name: (3aS)-6,8-dihydroxy-1-(1H-indol-3-yl)-3a,4-dihydrobenzo[e][1]benzofuran-2,5-dione

Structure

SMILES: O=C1O[C@H]2CC(=O)C3=C(O)C=C(O)C=C3C2=C1C1=CNC2=CC=CC=C12

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InChI: InChI=1S/C20H13NO5/c22-9-5-11-17(14(23)6-9)15(24)7-16-18(11)19(20(25)26-16)12-8-21-13-4-2-1-3-10(12)13/h1-6,8,16,21-23H,7H2/t16-/m0/s1

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InChIKey: BFVWTLLYXASUMY-INIZCTEOSA-N

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Source

Properties Information

Molecule Weight: 347.326

TPSA: 99.62

MolLogP: 3.0017000000000005

Number of H-Donors: 3

Number of H-Acceptors: 5

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information