Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C22H18ClF4NO8 |
| Molecular Weight | 535.827 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=CC=C(Cl)C=C1[C@]2(F)C(=O)N([C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O)C4=C2C=CC(=C4)C(F)(F)F
InChI
InChIKey=LHGCJCWQABXCEH-RDTNQEAYSA-N
InChI=1S/C22H18ClF4NO8/c1-35-13-5-3-9(23)7-11(13)21(24)10-4-2-8(22(25,26)27)6-12(10)28(20(21)34)18-16(31)14(29)15(30)17(36-18)19(32)33/h2-7,14-18,29-31H,1H3,(H,32,33)/t14-,15-,16+,17-,18+,21-/m0/s1
| Molecular Formula | C22H18ClF4NO8 |
| Molecular Weight | 535.827 |
| 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 16:00:53 UTC 2023
by
admin
on
Sat Dec 16 16:00:53 UTC 2023
|
| Record UNII |
5NW4S34D6A
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
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Systematic Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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5NW4S34D6A
Created by
admin on Sat Dec 16 16:00:53 UTC 2023 , Edited by admin on Sat Dec 16 16:00:53 UTC 2023
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PRIMARY | |||
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156596372
Created by
admin on Sat Dec 16 16:00:53 UTC 2023 , Edited by admin on Sat Dec 16 16:00:53 UTC 2023
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849819-51-8
Created by
admin on Sat Dec 16 16:00:53 UTC 2023 , Edited by admin on Sat Dec 16 16:00:53 UTC 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE |
URINE
|
||
|
PARENT -> METABOLITE |
PLASMA
|
