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Gene Set: D4 : CTD - Org 31710

Collection D4 : CTD
Chemical Name Org 31710 ( From PubChem : (6R,8S,11R,13S,14S,17R)-11-[4-(DIMETHYLAMINO)PHENYL]-6,13-DIMETHYL-1,4',5',6,7,8,11,12,13,14,15,16-DODECAHYDRO-3'H-SPIRO[CYCLOPENTA[A]PHENANTHRENE-17,2'-FURAN]-3(2H)-ONE )
FDA NPC WHO Indian Australia China Traditional
Herbal		 Clinical
Trail
NotNotNotNotNotNotNotNot
Molecular
Weight		 Hydrogen Bond
Donor Count		 Hydrogen Bond
Acceptor Count		 cLogP Lipinski Rule
445.636 g/mol 0 3 6.4473 False(3/4)
Structure
InChI InChI=1S/C30H39NO2/c1-19-16-25-27-12-14-30(13-5-15-33-30)29(27,2)18-26(20-6-8-21(9-7-20)31(3)4)28(25)23-11-10-22(32)17-24(19)23/h6-9,17,19,25-27H,5,10-16,18H2,1-4H3/t19-,25+,26-,27+,29+,30+/m1/s1
InChIKey HFDGABTZPISMDD-IEVXGSBISA-N
Links

Gene (3 / 7)


⊖ Less
Source Type Unit Value Gene PMID Assay Other
CTDdecreases(reaction)ICAM1
C076196
CTDincreases(expression)ICAM1
C076196
CTDdecreases(reaction)NOS3
C076196
CTDincreases(expression)NOS3
C076196
CTDincreases(phosphorylation)NOS3
C076196
CTDdecreases(reaction)VCAM1
C076196
CTDincreases(expression)VCAM1
C076196
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