(9R)-14-hydroxy-15,16-dimethoxy-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2(7),3,5,13,15-hexaen-11-one

AlkaPlorer ID: AK093700

Synonym: None

IUPAC Name: (6aR)-3-hydroxy-1,2-dimethoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-5-one

Structure

SMILES: COC1=C(O)C2=C3C(=C1OC)C1=CC=CC=C1C[C@H]3N=C(O)C2

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InChI: InChI=1S/C18H17NO4/c1-22-17-15-10-6-4-3-5-9(10)7-12-14(15)11(8-13(20)19-12)16(21)18(17)23-2/h3-6,12,21H,7-8H2,1-2H3,(H,19,20)/t12-/m1/s1

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InChIKey: YHTCCMRFBAMGJT-GFCCVEGCSA-N

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Source

Properties Information

Molecule Weight: 311.33700000000005

TPSA: 71.28

MolLogP: 3.1862000000000004

Number of H-Donors: 2

Number of H-Acceptors: 4

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Aedes aegypti Aedes aegypti Activity nan None 10.1021/np980565x
Mus musculus P388 ED50 30.0 mg/ml 10.1021/np980565x

Metabolism Information