Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C19H20N2O6S |
| Molecular Weight | 404.437 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CCOC1=C(O)C=CC(=C1)[C@@H](CS(C)(=O)=O)N2C(=O)C3=CC=CC(N)=C3C2=O
InChI
InChIKey=RNEPXCGHBYQJJA-CQSZACIVSA-N
InChI=1S/C19H20N2O6S/c1-3-27-16-9-11(7-8-15(16)22)14(10-28(2,25)26)21-18(23)12-5-4-6-13(20)17(12)19(21)24/h4-9,14,22H,3,10,20H2,1-2H3/t14-/m1/s1
| Molecular Formula | C19H20N2O6S |
| Molecular Weight | 404.437 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 10:08:35 GMT 2023
by
admin
on
Sat Dec 16 10:08:35 GMT 2023
|
| Record UNII |
98Z99JE779
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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98Z99JE779
Created by
admin on Sat Dec 16 10:08:35 GMT 2023 , Edited by admin on Sat Dec 16 10:08:35 GMT 2023
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57524404
Created by
admin on Sat Dec 16 10:08:35 GMT 2023 , Edited by admin on Sat Dec 16 10:08:35 GMT 2023
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1384440-16-7
Created by
admin on Sat Dec 16 10:08:35 GMT 2023 , Edited by admin on Sat Dec 16 10:08:35 GMT 2023
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
MINOR
FECAL
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