Details
Stereochemistry | ACHIRAL |
Molecular Formula | C10H9NO6 |
Molecular Weight | 239.1816 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OCC(=O)NC1=C(C(O)=O)C(=CC=C1)C(O)=O
InChI
InChIKey=SWINJNOTXKJEFQ-UHFFFAOYSA-N
InChI=1S/C10H9NO6/c12-4-7(13)11-6-3-1-2-5(9(14)15)8(6)10(16)17/h1-3,12H,4H2,(H,11,13)(H,14,15)(H,16,17)
Molecular Formula | C10H9NO6 |
Molecular Weight | 239.1816 |
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 10:08:15 GMT 2023
by
admin
on
Sat Dec 16 10:08:15 GMT 2023
|
Record UNII |
5FRG57226D
|
Record Status |
Validated (UNII)
|
Record Version |
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-
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1005516-29-9
Created by
admin on Sat Dec 16 10:08:15 GMT 2023 , Edited by admin on Sat Dec 16 10:08:15 GMT 2023
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5FRG57226D
Created by
admin on Sat Dec 16 10:08:15 GMT 2023 , Edited by admin on Sat Dec 16 10:08:15 GMT 2023
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91810656
Created by
admin on Sat Dec 16 10:08:15 GMT 2023 , Edited by admin on Sat Dec 16 10:08:15 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> METABOLITE |
MINOR
FECAL
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