Details
Stereochemistry | ACHIRAL |
Molecular Formula | C22H25NO4S |
Molecular Weight | 399.503 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CCCN1CC(=C(C1=O)C2=CC=C(CCO)C=C2)C3=CC=C(C=C3)S(C)(=O)=O
InChI
InChIKey=OBBDTDDLBJVAII-UHFFFAOYSA-N
InChI=1S/C22H25NO4S/c1-3-13-23-15-20(17-8-10-19(11-9-17)28(2,26)27)21(22(23)25)18-6-4-16(5-7-18)12-14-24/h4-11,24H,3,12-15H2,1-2H3
Molecular Formula | C22H25NO4S |
Molecular Weight | 399.503 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 15:08:36 UTC 2023
by
admin
on
Sat Dec 16 15:08:36 UTC 2023
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Record UNII |
MZ9JNU8TWR
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Record Status |
Validated (UNII)
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Record Version |
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-
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Common Name | English |
Code System | Code | Type | Description | ||
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156596883
Created by
admin on Sat Dec 16 15:08:37 UTC 2023 , Edited by admin on Sat Dec 16 15:08:37 UTC 2023
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PRIMARY | |||
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MZ9JNU8TWR
Created by
admin on Sat Dec 16 15:08:37 UTC 2023 , Edited by admin on Sat Dec 16 15:08:37 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> METABOLITE |
MAJOR
PLASMA
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PARENT -> METABOLITE |
URINE
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