Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C22H25F2NO4 |
Molecular Weight | 405.435 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@@]1(CCC2=CC(F)=CC=C2O1)[C@H](O)CNC[C@@H](O)[C@]3([H])CCC4=CC(F)=CC=C4O3
InChI
InChIKey=KOHIRBRYDXPAMZ-YHBROIRLSA-N
InChI=1S/C22H25F2NO4/c23-15-3-7-19-13(9-15)1-5-21(28-19)17(26)11-25-12-18(27)22-6-2-14-10-16(24)4-8-20(14)29-22/h3-4,7-10,17-18,21-22,25-27H,1-2,5-6,11-12H2/t17-,18-,21-,22+/m1/s1
Molecular Formula | C22H25F2NO4 |
Molecular Weight | 405.435 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 16:00:46 UTC 2023
by
admin
on
Fri Dec 15 16:00:46 UTC 2023
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Record UNII |
I43D0296P8
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Record Status |
Validated (UNII)
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Record Version |
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-
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Code | English | ||
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C29576
Created by
admin on Fri Dec 15 16:00:46 UTC 2023 , Edited by admin on Fri Dec 15 16:00:46 UTC 2023
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Code System | Code | Type | Description | ||
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118457-15-1
Created by
admin on Fri Dec 15 16:00:46 UTC 2023 , Edited by admin on Fri Dec 15 16:00:46 UTC 2023
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300000034249
Created by
admin on Fri Dec 15 16:00:46 UTC 2023 , Edited by admin on Fri Dec 15 16:00:46 UTC 2023
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8938
Created by
admin on Fri Dec 15 16:00:46 UTC 2023 , Edited by admin on Fri Dec 15 16:00:46 UTC 2023
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C90796
Created by
admin on Fri Dec 15 16:00:46 UTC 2023 , Edited by admin on Fri Dec 15 16:00:46 UTC 2023
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189562
Created by
admin on Fri Dec 15 16:00:46 UTC 2023 , Edited by admin on Fri Dec 15 16:00:46 UTC 2023
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PRIMARY | |||
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I43D0296P8
Created by
admin on Fri Dec 15 16:00:46 UTC 2023 , Edited by admin on Fri Dec 15 16:00:46 UTC 2023
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PRIMARY | |||
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64021
Created by
admin on Fri Dec 15 16:00:46 UTC 2023 , Edited by admin on Fri Dec 15 16:00:46 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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TARGET -> INHIBITOR |
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BINDER->LIGAND |
BINDING
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Related Record | Type | Details | ||
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ACTIVE MOIETY |
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Name | Property Type | Amount | Referenced Substance | Defining | Parameters | References |
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blood-to-plasma ratio | PHARMACOKINETIC |
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Volume of Distribution | PHARMACOKINETIC |
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IN THE PM POPULATION |
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Tmax | PHARMACOKINETIC |
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Volume of Distribution | PHARMACOKINETIC |
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IN THE EM POPULATION |
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