(6S,7R,8R)-6',7'-dimethoxy-2'-methyl-3',4',6,8-tetrahydro-2H-spiro[indeno[4,5-d][1,3]dioxole-7,1'-isoquinoline]-6,8-diol

AlkaPlorer ID: AK100497

Synonym: None

IUPAC Name: (1R,6'S,8'R)-6,7-dimethoxy-2-methylspiro[3,4-dihydroisoquinoline-1,7'-6,8-dihydrocyclopenta[g][1,3]benzodioxole]-6',8'-diol

Structure

SMILES: COC1=C(OC)C=C2C(=C1)CCN(C)[C@]21[C@H](O)C2=C3OCOC3=CC=C2[C@@H]1O

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InChI: InChI=1S/C21H23NO6/c1-22-7-6-11-8-15(25-2)16(26-3)9-13(11)21(22)19(23)12-4-5-14-18(28-10-27-14)17(12)20(21)24/h4-5,8-9,19-20,23-24H,6-7,10H2,1-3H3/t19-,20+,21+/m0/s1

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InChIKey: GBRMPBIZRSWCMZ-PWRODBHTSA-N

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Source

Properties Information

Molecule Weight: 385.4160000000001

TPSA: 80.62000000000002

MolLogP: 1.8963

Number of H-Donors: 2

Number of H-Acceptors: 7

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information