Thalipine

AlkaPlorer ID: AK146849

Synonym: ''

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

Structure

SMILES: COC1=CC2=C(C=C1O)[C@H](CC1=CC(O)=C(OC)C=C1OC1=CC3=C(C=C1OC)C1=C(OC)C(OC)=CC4=C1[C@H](C3)N(C)CC4)N(C)CC2

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InChI: InChI=1S/C39H44N2O8/c1-40-10-8-21-15-32(44-3)30(43)18-25(21)27(40)13-24-14-29(42)33(45-4)20-31(24)49-35-17-23-12-28-37-22(9-11-41(28)2)16-36(47-6)39(48-7)38(37)26(23)19-34(35)46-5/h14-20,27-28,42-43H,8-13H2,1-7H3/t27-,28-/m0/s1

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InChIKey: YUHPJUJTENZURH-NSOVKSMOSA-N

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Source

Properties Information

Molecule Weight: 668.7869999999998

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