Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C26H26F3NO9 |
| Molecular Weight | 553.4811 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O[C@@H]1[C@@H](O)[C@H](OC(=O)CCCC2(C(=O)NCC(F)(F)F)C3=C(C=CC=C3)C4=C2C=CC=C4)O[C@@H]([C@H]1O)C(O)=O
InChI
InChIKey=LCAMEDGEERXORV-KHYDEXNFSA-N
InChI=1S/C26H26F3NO9/c27-26(28,29)12-30-24(37)25(15-8-3-1-6-13(15)14-7-2-4-9-16(14)25)11-5-10-17(31)38-23-20(34)18(32)19(33)21(39-23)22(35)36/h1-4,6-9,18-21,23,32-34H,5,10-12H2,(H,30,37)(H,35,36)/t18-,19-,20+,21-,23+/m0/s1
| Molecular Formula | C26H26F3NO9 |
| Molecular Weight | 553.4811 |
| 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 15:17:15 GMT 2023
by
admin
on
Sat Dec 16 15:17:15 GMT 2023
|
| Record UNII |
AKK3AB9GSJ
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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Systematic Name | English | ||
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Common Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
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138454974
Created by
admin on Sat Dec 16 15:17:15 GMT 2023 , Edited by admin on Sat Dec 16 15:17:15 GMT 2023
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PRIMARY | |||
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AKK3AB9GSJ
Created by
admin on Sat Dec 16 15:17:15 GMT 2023 , Edited by admin on Sat Dec 16 15:17:15 GMT 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
In plasma, M10+M18 accounted for 9.67% (combined) of the total radioactivity in 0 – 24 hours plasma samples. In urine, M18 was the prominent metabolite, which accounted for 3.77% of the dose in the 0 – 96 hours urine samples.
PLASMA; URINE
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