Serotobenine; 8-Oxo

AlkaPlorer ID: AK313414

Synonym: Flavumindole

IUPAC Name: 3-(4-hydroxy-3-methoxyphenyl)-2-oxa-6,11-diazatetracyclo[7.5.2.04,15.012,16]hexadeca-1(15),9,12(16),13-tetraene-5,8-dione

Structure

SMILES: COC1=CC(C2OC3=CC=C4NC=C5C(=O)CN=C(O)C2C3=C54)=CC=C1O

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InChI: InChI=1S/C20H16N2O5/c1-26-15-6-9(2-4-12(15)23)19-18-17-14(27-19)5-3-11-16(17)10(7-21-11)13(24)8-22-20(18)25/h2-7,18-19,21,23H,8H2,1H3,(H,22,25)

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InChIKey: BATKVFDLIDCNEK-UHFFFAOYSA-N

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Source

Properties Information

Molecule Weight: 364.3570000000001

TPSA: 104.14

MolLogP: 3.252200000000001

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