Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C17H20ClNO8 |
| Molecular Weight | 401.796 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
C[C@H]1CN(O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)C(=O)CC3=C1C=C(Cl)C=C3
InChI
InChIKey=XNPMZCMFSCQFAB-YQWRCXIDSA-N
InChI=1S/C17H20ClNO8/c1-7-6-19(11(20)4-8-2-3-9(18)5-10(7)8)27-17-14(23)12(21)13(22)15(26-17)16(24)25/h2-3,5,7,12-15,17,21-23H,4,6H2,1H3,(H,24,25)/t7-,12-,13-,14+,15-,17-/m0/s1
| Molecular Formula | C17H20ClNO8 |
| Molecular Weight | 401.796 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 18:26:18 GMT 2023
by
admin
on
Sat Dec 16 18:26:18 GMT 2023
|
| Record UNII |
D94D8M36Y4
|
| Record Status |
Validated (UNII)
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| Record Version |
|
-
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D94D8M36Y4
Created by
admin on Sat Dec 16 18:26:18 GMT 2023 , Edited by admin on Sat Dec 16 18:26:18 GMT 2023
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155928949
Created by
admin on Sat Dec 16 18:26:18 GMT 2023 , Edited by admin on Sat Dec 16 18:26:18 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
M8 (1-carboxyl glucuronide) was excreted in urine greater than 10% of dose, but it was a minor metabolite in plasma.
URINE
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