(9S)-10-[(2S)-2-hydroxypropyl]-4,16-dimethoxy-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2(7),3,5,13,15-hexaene-3,15-diol

AlkaPlorer ID: AK357494

Synonym: None

IUPAC Name: 6-(2-hydroxypropyl)-1,10-dimethoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-2,11-diol

Structure

SMILES: COC1=CC=C2CC3C4=C(C=C(O)C(OC)=C4C2=C1O)CCN3CC(C)O

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InChI: InChI=1S/C21H25NO5/c1-11(23)10-22-7-6-13-9-15(24)21(27-3)19-17(13)14(22)8-12-4-5-16(26-2)20(25)18(12)19/h4-5,9,11,14,23-25H,6-8,10H2,1-3H3

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InChIKey: CPJQTONOKGWFSY-UHFFFAOYSA-N

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Source

Properties Information

Molecule Weight: 371.4330000000001

TPSA: 82.39

MolLogP: 2.6181000000000005

Number of H-Donors: 3

Number of H-Acceptors: 6

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information