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Gene Set: D4 : CTD - Monocrotaline

Collection D4 : CTD
Chemical Name Monocrotaline ( From PubChem : 20-NORCROTALANAN-11,15-DIONE, 14,19-DIHYDRO-12,13-DIHYDROXY-, (13.ALPHA.,14.ALPHA.)- )
FDA NPC WHO Indian Australia China Traditional
Herbal		 Clinical
Trail
NotNotNotNotNotNotNotNot
Molecular
Weight		 Hydrogen Bond
Donor Count		 Hydrogen Bond
Acceptor Count		 cLogP Lipinski Rule
325.357 g/mol 2 7 -0.4547 True
Structure
InChI InChI=1S/C16H23NO6/c1-9-13(18)23-11-5-7-17-6-4-10(12(11)17)8-22-14(19)16(3,21)15(9,2)20/h4,9,11-12,20-21H,5-8H2,1-3H3/t9-,11+,12-,15-,16+/m0/s1
InChIKey QVCMHGGNRFRMAD-OLZGDFGGSA-N
Links

Gene (9 / 14)


⊖ Less
Source Type Unit Value Gene PMID Assay Other
CTDincreases(activity)CYP2C19
D016686
CTDincreases(metabolic processing)CYP2C19
D016686
CTDincreases(activity)CYP3A4
D016686
CTDincreases(metabolic processing)CYP3A4
D016686
CTDdecreases(reaction)SLC22A1
D016686
CTDincreases(uptake)SLC22A1
D016686
CTDincreases(expression)SLC6A4
D016686
CTDdecreases(reaction)SLC6A4
D016686
PubChem NoneuMCFTR-GI(Protien) :
PubChem NoneuMGOPC-GI(Protien) :
PubChem NoneuMNR0B1-GI(Protien) :
PubChem PotencyuM5.805TDP1-GI(Protien) :
PubChem PotencyuM11.582TDP1-GI(Protien) :
PubChem NoneuMTRHR-GI(Protien) :
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