Details
Stereochemistry | ACHIRAL |
Molecular Formula | C19H18O6S |
Molecular Weight | 374.408 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=C(OC2=C1C(=O)C(=O)C3=C2C=CC4=C3CCCC4(C)C)S(O)(=O)=O
InChI
InChIKey=UJCACMLMPLLRGW-UHFFFAOYSA-N
InChI=1S/C19H18O6S/c1-9-13-15(20)16(21)14-10-5-4-8-19(2,3)12(10)7-6-11(14)17(13)25-18(9)26(22,23)24/h6-7H,4-5,8H2,1-3H3,(H,22,23,24)
Molecular Formula | C19H18O6S |
Molecular Weight | 374.408 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Targets
Primary Target | Pharmacology | Condition | Potency |
---|---|---|---|
Target ID: O00748 Gene ID: 8824.0 Gene Symbol: CES2 Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/23286284 |
3.9 µM [Ki] |
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 11:46:33 GMT 2023
by
admin
on
Sat Dec 16 11:46:33 GMT 2023
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Record UNII |
5CKR8JG9OW
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Record Status |
Validated (UNII)
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Record Version |
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125782
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5CKR8JG9OW
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105937-56-2
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admin on Sat Dec 16 11:46:33 GMT 2023 , Edited by admin on Sat Dec 16 11:46:33 GMT 2023
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ACTIVE MOIETY |