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tetrandrine Report issue

Small molecule Experimental

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Chemistry

Mol. Mass

622.7499

ALogP

Rule of 5

Rule of 3

Missing data

Details

SMILES: COC1=CC=C2C[C@@H]3N(C)CCC4=C3C(OC5=CC6=C(CCN(C)[C@H]6CC7=CC=C(OC1=C2)C=C7)C=C5OC)=C(OC)C(OC)=C4
InChIKey: WVTKBKWTSCPRNU-KYJUHHDHSA-N
1S/C38H42N2O6/c1-39-15-13-25-20-32(42-4)34-22-28(25)29(39)17-23-7-10-27(11-8-23)45-33-19-24(9-12-31(33)41-3)18-30-36-26(14-16-40(30)2)21-35(43-5)37(44-6)38(36)46-34/h7-12,19-22,29-30H,13-18H2,1-6H3/t29-,30-/m0/s1
Chirality: None
Inorganic: Missing data
Polymer: Missing data

Sources

29EX23D5AJ NCATS
tetrandrine *

Tetrandrine Wikipedia

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