Details
Stereochemistry | RACEMIC |
Molecular Formula | C17H16O4S |
Molecular Weight | 316.372 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@]1(COC(=O)[C@]1([H])C2=CC=CC=C2)C3=CC=C(C=C3)S(C)(=O)=O
InChI
InChIKey=PHCFUFKRCHEUTJ-JKSUJKDBSA-N
InChI=1S/C17H16O4S/c1-22(19,20)14-9-7-12(8-10-14)15-11-21-17(18)16(15)13-5-3-2-4-6-13/h2-10,15-16H,11H2,1H3/t15-,16+/m0/s1
Molecular Formula | C17H16O4S |
Molecular Weight | 316.372 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 15:22:54 GMT 2023
by
admin
on
Sat Dec 16 15:22:54 GMT 2023
|
Record UNII |
2VL6DH29WP
|
Record Status |
Validated (UNII)
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Record Version |
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-
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101079917
Created by
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308364-87-6
Created by
admin on Sat Dec 16 15:22:54 GMT 2023 , Edited by admin on Sat Dec 16 15:22:54 GMT 2023
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2VL6DH29WP
Created by
admin on Sat Dec 16 15:22:54 GMT 2023 , Edited by admin on Sat Dec 16 15:22:54 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> METABOLITE |
IN VITRO
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