Przewalstine; 10'-Demethoxy, O7',O12'-di-de-Me 

AlkaPlorer ID: AK311371

Synonym: Istanbulamine

IUPAC Name: 1-[[4-hydroxy-3-[(1,2,3,10-tetramethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-9-yl)oxy]phenyl]methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol

Structure

SMILES: COC1=CC2=C(C=C1O)C(CC1=CC=C(O)C(OC3=CC4=C(C=C3OC)C3=C(OC)C(OC)=C(OC)C5=C3C(C4)N(C)CC5)=C1)N(C)CC2

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InChI: InChI=1S/C39H44N2O8/c1-40-12-10-22-17-31(44-3)30(43)19-25(22)27(40)14-21-8-9-29(42)32(15-21)49-34-18-23-16-28-35-24(11-13-41(28)2)37(46-5)39(48-7)38(47-6)36(35)26(23)20-33(34)45-4/h8-9,15,17-20,27-28,42-43H,10-14,16H2,1-7H3

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InChIKey: LYWQLDHXGWXMKR-UHFFFAOYSA-N

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Reference

PubChem CID: 163033714

COCONUT: CNP0312885.1

Source

Properties Information

Molecule Weight: 668.7869999999999

TPSA: 102.32

MolLogP: 6.456900000000008

Number of H-Donors: 2

Number of H-Acceptors: 10

RingCount: 7

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information