Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C29H30FN3O |
Molecular Weight | 455.5664 |
Optical Activity | ( - ) |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
Stereo Comments | ASSUMED R FROM AZELASTINE OPTICAL ROTATION AND BIOACTIVITY |
SHOW SMILES / InChI
SMILES
FC1=CC=C(CC2=NN([C@@H]3CCCN(CCC4=CC=CC=C4)CC3)C(=O)C5=C2C=CC=C5)C=C1
InChI
InChIKey=HQFSNUYUXXPVKL-RUZDIDTESA-N
InChI=1S/C29H30FN3O/c30-24-14-12-23(13-15-24)21-28-26-10-4-5-11-27(26)29(34)33(31-28)25-9-6-18-32(20-17-25)19-16-22-7-2-1-3-8-22/h1-5,7-8,10-15,25H,6,9,16-21H2/t25-/m1/s1
Molecular Formula | C29H30FN3O |
Molecular Weight | 455.5664 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 20:23:20 GMT 2023
by
admin
on
Fri Dec 15 20:23:20 GMT 2023
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Record UNII |
YT7JWK8OC5
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Record Status |
Validated (UNII)
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Record Version |
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-
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76961011
Created by
admin on Fri Dec 15 20:23:20 GMT 2023 , Edited by admin on Fri Dec 15 20:23:20 GMT 2023
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PRIMARY | PUBCHEM | ||
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153408-35-6
Created by
admin on Fri Dec 15 20:23:20 GMT 2023 , Edited by admin on Fri Dec 15 20:23:20 GMT 2023
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PRIMARY | |||
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YT7JWK8OC5
Created by
admin on Fri Dec 15 20:23:20 GMT 2023 , Edited by admin on Fri Dec 15 20:23:20 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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ENANTIOMER -> ENANTIOMER |
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RACEMATE -> ENANTIOMER |