GEN25_41.1
AlkaPlorer ID: AK003295
Synonym: None
IUPAC Name: (3S)-5-(4,5-dimethoxy-7-methylnaphthalen-1-yl)-6,8-dimethoxy-3-methyl-1,2,3,4-tetrahydroisoquinoline
Structure
SMILES: COC1=CC(OC)=C(C2=CC=C(OC)C3=C(OC)C=C(C)C=C23)C2=C1CN[C@@H](C)C2
InChI: InChI=1S/C25H29NO4/c1-14-9-17-16(7-8-20(27-3)25(17)22(10-14)29-5)24-18-11-15(2)26-13-19(18)21(28-4)12-23(24)30-6/h7-10,12,15,26H,11,13H2,1-6H3/t15-/m0/s1
InChIKey: FSHBEGRPPCFVBJ-HNNXBMFYSA-N
Source
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Properties Information
Molecule Weight: 407.5100000000002
TPSA？: 48.95
MolLogP？: 4.8838200000000045
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 4
Activities Information
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