Thalicarpine; O1,O7'-Di-de-Me
AlkaPlorer ID: AK315760
Synonym: Thalictrogamine
IUPAC Name: 9-[2-[(7-hydroxy-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]-4,5-dimethoxyphenoxy]-2,10-dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-1-ol
Structure
SMILES: COC1=CC2=C(C=C1O)C(CC1=CC(OC)=C(OC)C=C1OC1=CC3=C(C=C1OC)C1=C(O)C(OC)=CC4=C1C(C3)N(C)CC4)N(C)CC2
InChI: InChI=1S/C39H44N2O8/c1-40-10-8-21-14-31(44-3)29(42)18-25(21)27(40)13-24-17-32(45-4)34(47-6)20-30(24)49-35-16-23-12-28-37-22(9-11-41(28)2)15-36(48-7)39(43)38(37)26(23)19-33(35)46-5/h14-20,27-28,42-43H,8-13H2,1-7H3
InChIKey: HILKIZRODBIOMK-UHFFFAOYSA-N
Source
Properties Information
Molecule Weight: 668.7869999999998
TPSA？: 102.32
MolLogP？: 6.456900000000007
Number of H-Donors: 2
Number of H-Acceptors: 10
RingCount: 7
Activities Information
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