(5R)-6-methyl-5-[(10S)-3,5,11-trioxatricyclo[7.3.0.0²,⁶]dodeca-1(9),2(6),7-trien-10-yl]-2H,5H,7H,8H-[1,3]dioxolo[4,5-g]isoquinoline

AlkaPlorer ID: AK269791

Synonym: None

IUPAC Name: (5R)-5-[(6S)-6,8-dihydrofuro[3,4-g][1,3]benzodioxol-6-yl]-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline

Structure

SMILES: CN1CCC2=CC3=C(C=C2[C@@H]1[C@H]1OCC2=C1C=CC1=C2OCO1)OCO3

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InChI: InChI=1S/C20H19NO5/c1-21-5-4-11-6-16-17(25-9-24-16)7-13(11)18(21)20-12-2-3-15-19(26-10-23-15)14(12)8-22-20/h2-3,6-7,18,20H,4-5,8-10H2,1H3/t18-,20+/m1/s1

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InChIKey: AACMFFIUYXGCOC-QUCCMNQESA-N

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Source

Properties Information

Molecule Weight: 353.37400000000014

TPSA: 49.39

MolLogP: 2.944500000000001

Number of H-Donors: 0

Number of H-Acceptors: 6

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information