Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C21H20NO6.Cl |
Molecular Weight | 417.84 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Cl-].[H][C@]1(OC(=O)C2=C3OCOC3=CC=C12)[C@]4([H])C5=CC6=C(OCO6)C=C5CC[N+]4(C)C
InChI
InChIKey=RLJKFAMYSYWMND-GRTNUQQKSA-M
InChI=1S/C21H20NO6.ClH/c1-22(2)6-5-11-7-15-16(26-9-25-15)8-13(11)18(22)19-12-3-4-14-20(27-10-24-14)17(12)21(23)28-19;/h3-4,7-8,18-19H,5-6,9-10H2,1-2H3;1H/q+1;/p-1/t18-,19+;/m0./s1
Approval Year
Targets
Primary Target | Pharmacology | Condition | Potency |
---|---|---|---|
Target ID: CHEMBL1907607 |
38.0 µM [Ki] | ||
Target ID: CHEMBL3780 Sources: https://www.ncbi.nlm.nih.gov/pubmed/18998663 |
7.0 µM [IC50] |
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38641-83-7
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DTXSID90191956
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I3UNE1K4AF
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admin on Fri Dec 15 19:21:55 GMT 2023 , Edited by admin on Fri Dec 15 19:21:55 GMT 2023
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10047593
Created by
admin on Fri Dec 15 19:21:55 GMT 2023 , Edited by admin on Fri Dec 15 19:21:55 GMT 2023
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C006749
Created by
admin on Fri Dec 15 19:21:55 GMT 2023 , Edited by admin on Fri Dec 15 19:21:55 GMT 2023
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SUBSTANCE RECORD