Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C21H24FN3O4.ClH |
Molecular Weight | 437.892 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.[H][C@]12CN(C[C@@]1([H])NCCC2)C3=C(OC)C4=C(C=C3F)C(=O)C(=CN4C5CC5)C(O)=O
InChI
InChIKey=IDIIJJHBXUESQI-DFIJPDEKSA-N
InChI=1S/C21H24FN3O4.ClH/c1-29-20-17-13(19(26)14(21(27)28)9-25(17)12-4-5-12)7-15(22)18(20)24-8-11-3-2-6-23-16(11)10-24;/h7,9,11-12,16,23H,2-6,8,10H2,1H3,(H,27,28);1H/t11-,16+;/m0./s1
Molecular Formula | ClH |
Molecular Weight | 36.461 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C21H24FN3O4 |
Molecular Weight | 401.4314 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:45:36 UTC 2023
by
admin
on
Fri Dec 15 15:45:36 UTC 2023
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Record UNII |
C53598599T
|
Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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FDA ORPHAN DRUG |
428014
Created by
admin on Fri Dec 15 15:45:36 UTC 2023 , Edited by admin on Fri Dec 15 15:45:36 UTC 2023
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NCI_THESAURUS |
C795
Created by
admin on Fri Dec 15 15:45:36 UTC 2023 , Edited by admin on Fri Dec 15 15:45:36 UTC 2023
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Code System | Code | Type | Description | ||
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186826-86-8
Created by
admin on Fri Dec 15 15:45:36 UTC 2023 , Edited by admin on Fri Dec 15 15:45:36 UTC 2023
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PRIMARY | |||
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C53598599T
Created by
admin on Fri Dec 15 15:45:36 UTC 2023 , Edited by admin on Fri Dec 15 15:45:36 UTC 2023
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PRIMARY | |||
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100000089652
Created by
admin on Fri Dec 15 15:45:36 UTC 2023 , Edited by admin on Fri Dec 15 15:45:36 UTC 2023
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PRIMARY | |||
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KK-69
Created by
admin on Fri Dec 15 15:45:36 UTC 2023 , Edited by admin on Fri Dec 15 15:45:36 UTC 2023
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PRIMARY | |||
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SUB03342MIG
Created by
admin on Fri Dec 15 15:45:36 UTC 2023 , Edited by admin on Fri Dec 15 15:45:36 UTC 2023
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PRIMARY | |||
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DBSALT000387
Created by
admin on Fri Dec 15 15:45:36 UTC 2023 , Edited by admin on Fri Dec 15 15:45:36 UTC 2023
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PRIMARY | |||
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DTXSID4045921
Created by
admin on Fri Dec 15 15:45:36 UTC 2023 , Edited by admin on Fri Dec 15 15:45:36 UTC 2023
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228750
Created by
admin on Fri Dec 15 15:45:36 UTC 2023 , Edited by admin on Fri Dec 15 15:45:36 UTC 2023
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PRIMARY | RxNorm | ||
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m7647
Created by
admin on Fri Dec 15 15:45:36 UTC 2023 , Edited by admin on Fri Dec 15 15:45:36 UTC 2023
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PRIMARY | Merck Index | ||
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1448606
Created by
admin on Fri Dec 15 15:45:36 UTC 2023 , Edited by admin on Fri Dec 15 15:45:36 UTC 2023
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CHEMBL32
Created by
admin on Fri Dec 15 15:45:36 UTC 2023 , Edited by admin on Fri Dec 15 15:45:36 UTC 2023
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101526
Created by
admin on Fri Dec 15 15:45:36 UTC 2023 , Edited by admin on Fri Dec 15 15:45:36 UTC 2023
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7008
Created by
admin on Fri Dec 15 15:45:36 UTC 2023 , Edited by admin on Fri Dec 15 15:45:36 UTC 2023
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C53598599T
Created by
admin on Fri Dec 15 15:45:36 UTC 2023 , Edited by admin on Fri Dec 15 15:45:36 UTC 2023
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758875
Created by
admin on Fri Dec 15 15:45:36 UTC 2023 , Edited by admin on Fri Dec 15 15:45:36 UTC 2023
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PRIMARY | |||
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C38696
Created by
admin on Fri Dec 15 15:45:36 UTC 2023 , Edited by admin on Fri Dec 15 15:45:36 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
---|---|---|---|---|
|
BASIS OF STRENGTH->SUBSTANCE |
ASSAY (HPLC)
USP
|
||
|
SOLVATE->ANHYDROUS | |||
|
PARENT -> SALT/SOLVATE |
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Related Record | Type | Details | ||
---|---|---|---|---|
|
IMPURITY -> PARENT | |||
|
IMPURITY -> PARENT |
|
||
|
IMPURITY -> PARENT |
|
||
|
IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
||
|
IMPURITY -> PARENT |
For the calculation of contents, multiply the peak areas by 3.5
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
||
|
IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
||
|
IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
||
|
IMPURITY -> PARENT |
For the calculation of contents, multiply the peak areas by 1.4
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
Related Record | Type | Details | ||
---|---|---|---|---|
|
ACTIVE MOIETY |