Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C25H33FO8 |
| Molecular Weight | 480.5231 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 7 / 7 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(O)C(=O)COC(=O)CCC(O)=O
InChI
InChIKey=RRDDXLOWDKTRPZ-WRCNZEDTSA-N
InChI=1S/C25H33FO8/c1-22-9-7-15(27)11-14(22)3-4-17-16-8-10-24(33,23(16,2)12-18(28)25(17,22)26)19(29)13-34-21(32)6-5-20(30)31/h11,16-18,28,33H,3-10,12-13H2,1-2H3,(H,30,31)/t16-,17-,18-,22-,23-,24-,25-/m0/s1
| Molecular Formula | C25H33FO8 |
| Molecular Weight | 480.5231 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 7 / 7 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
Overview
| CYP3A4 | CYP2C9 | CYP2D6 | hERG |
|---|---|---|---|
OverviewOther
| Other Inhibitor | Other Substrate | Other Inducer |
|---|---|---|
Drug as perpetrator​
| Target | Modality | Activity | Metabolite | Clinical evidence |
|---|---|---|---|---|
| no [IC50 >10 uM] | ||||
| no | ||||
| no | ||||
| no | ||||
| no | ||||
| no | ||||
| no | ||||
| yes [Inhibition 10 uM] | ||||
| yes [Inhibition 10 uM] |
Drug as victim
| Target | Modality | Activity | Metabolite | Clinical evidence |
|---|---|---|---|---|
| yes |
Tox targets
| Target | Modality | Activity | Metabolite | Clinical evidence |
|---|---|---|---|---|
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 17:46:01 GMT 2025
by
admin
on
Mon Mar 31 17:46:01 GMT 2025
|
| Record UNII |
MS1UFS6FAB
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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Common Name | English | ||
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DTXSID40187521
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339-01-5
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admin on Mon Mar 31 17:46:01 GMT 2025 , Edited by admin on Mon Mar 31 17:46:01 GMT 2025
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MS1UFS6FAB
Created by
admin on Mon Mar 31 17:46:01 GMT 2025 , Edited by admin on Mon Mar 31 17:46:01 GMT 2025
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71463598
Created by
admin on Mon Mar 31 17:46:01 GMT 2025 , Edited by admin on Mon Mar 31 17:46:01 GMT 2025
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