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Gene Set: D4 : CTD - dioscin

Collection D4 : CTD
Chemical Name dioscin ( From PubChem : DIOSCIN )
FDA NPC WHO Indian Australia China Traditional
Herbal		 Clinical
Trail
NotNotNotNotNotNotNotNot
Molecular
Weight		 Hydrogen Bond
Donor Count		 Hydrogen Bond
Acceptor Count		 cLogP Lipinski Rule
869.044 g/mol 8 16 1.2417 False(1/4)
Structure
InChI InChI=1S/C45H72O16/c1-19-9-14-45(54-18-19)20(2)30-28(61-45)16-27-25-8-7-23-15-24(10-12-43(23,5)26(25)11-13-44(27,30)6)57-42-39(60-41-36(52)34(50)32(48)22(4)56-41)37(53)38(29(17-46)58-42)59-40-35(51)33(49)31(47)21(3)55-40/h7,19-22,24-42,46-53H,8-18H2,1-6H3/t19-,20+,21+,22+,24+,25?,26?,27?,28?,29-,30?,31+,32+,33-,34-,35-,36-,37+,38-,39-,40+,41+,42-,43+,44+,45-/m1/s1
InChIKey VNONINPVFQTJOC-GZEGCGEUSA-N
Links

Gene (2 / 3)


⊖ Less
Source Type Unit Value Gene PMID Assay Other
CTDdecreases(expression)ABCB1
C019357
CTDdecreases(degradation)NFKBIA
C019357
ChEMBLInhibition-NFKBIA
-Target : CHEMBL2898
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