Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C22H22N2O10S |
| Molecular Weight | 506.482 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=C(C(=NO1)C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)NO[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)C(O)=O
InChI
InChIKey=REJXOOSWPXPJJC-OTVISBKVSA-N
InChI=1S/C22H22N2O10S/c1-11-15(16(23-33-11)13-5-3-2-4-6-13)12-7-9-14(10-8-12)35(30,31)24-34-22-19(27)17(25)18(26)20(32-22)21(28)29/h2-10,17-20,22,24-27H,1H3,(H,28,29)/t17-,18-,19+,20-,22-/m0/s1
| Molecular Formula | C22H22N2O10S |
| Molecular Weight | 506.482 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 15:40:29 GMT 2023
by
admin
on
Sat Dec 16 15:40:29 GMT 2023
|
| Record UNII |
SQ8DN6Y4MK
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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501093-56-7
Created by
admin on Sat Dec 16 15:40:29 GMT 2023 , Edited by admin on Sat Dec 16 15:40:29 GMT 2023
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SQ8DN6Y4MK
Created by
admin on Sat Dec 16 15:40:29 GMT 2023 , Edited by admin on Sat Dec 16 15:40:29 GMT 2023
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156028043
Created by
admin on Sat Dec 16 15:40:29 GMT 2023 , Edited by admin on Sat Dec 16 15:40:29 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE |
URINE
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