Details
Stereochemistry | ABSOLUTE |
Molecular Formula | 2C24H31FO6.H2O |
Molecular Weight | 887.0108 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 18 / 18 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O.[H][C@@]12C[C@@]3([H])[C@]4([H])C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4([H])[C@@H](O)C[C@]3(C)[C@@]1(OC(C)(C)O2)C(=O)CO.[H][C@@]67C[C@@]8([H])[C@]9([H])C[C@H](F)C%10=CC(=O)C=C[C@]%10(C)[C@@]9([H])[C@@H](O)C[C@]8(C)[C@@]6(OC(C)(C)O7)C(=O)CO
InChI
InChIKey=MIXMJCQRHVAJIO-TZHJZOAOSA-N
InChI=1S/2C24H31FO6.H2O/c2*1-21(2)30-19-9-14-13-8-16(25)15-7-12(27)5-6-22(15,3)20(13)17(28)10-23(14,4)24(19,31-21)18(29)11-26;/h2*5-7,13-14,16-17,19-20,26,28H,8-11H2,1-4H3;1H2/t2*13-,14-,16-,17-,19+,20+,22-,23-,24+;/m00./s1
Molecular Formula | H2O |
Molecular Weight | 18.0153 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C24H31FO6 |
Molecular Weight | 434.4977 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 8 / 9 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:33:07 UTC 2023
by
admin
on
Fri Dec 15 15:33:07 UTC 2023
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Record UNII |
QK4DYS664X
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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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WHO-VATC |
QR01AD04
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WHO-ATC |
R03BA03
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NDF-RT |
N0000175576
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WHO-ATC |
R01AD04
Created by
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WHO-VATC |
QR03BA03
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admin on Fri Dec 15 15:33:07 UTC 2023 , Edited by admin on Fri Dec 15 15:33:07 UTC 2023
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NCI_THESAURUS |
C521
Created by
admin on Fri Dec 15 15:33:07 UTC 2023 , Edited by admin on Fri Dec 15 15:33:07 UTC 2023
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7076
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C29054
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SUB13899MIG
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11954221
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1274505
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1298840
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DTXSID30998562
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77326-96-6
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QK4DYS664X
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CHEMBL1512
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FLUNISOLIDE
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5106
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757871
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QK4DYS664X
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C007734
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DB00180
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25120
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Flunisolide
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1201
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Related Record | Type | Details | ||
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TARGET -> AGONIST | |||
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PARENT -> SALT/SOLVATE | |||
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ANHYDROUS->SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |
Name | Property Type | Amount | Referenced Substance | Defining | Parameters | References |
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Biological Half-life | PHARMACOKINETIC |
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Volume of Distribution | PHARMACOKINETIC |
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