Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C31H36NO3.Br |
| Molecular Weight | 550.526 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Br-].COC1=CC2=C(C=C1OC)C(=O)C(CC3CC[N+](CC4=CC=CC=C4)(CC5=CC=CC=C5)CC3)C2
InChI
InChIKey=SSZOWVQOUFMSCQ-UHFFFAOYSA-M
InChI=1S/C31H36NO3.BrH/c1-34-29-19-26-18-27(31(33)28(26)20-30(29)35-2)17-23-13-15-32(16-14-23,21-24-9-5-3-6-10-24)22-25-11-7-4-8-12-25;/h3-12,19-20,23,27H,13-18,21-22H2,1-2H3;1H/q+1;/p-1
| Molecular Formula | BrH |
| Molecular Weight | 80.912 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C31H36NO3 |
| Molecular Weight | 470.6224 |
| Charge | 1 |
| Count |
|
| Stereochemistry | MIXED |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 2 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 19:26:07 GMT 2025
by
admin
on
Mon Mar 31 19:26:07 GMT 2025
|
| Record UNII |
2L83S3XLZA
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
Download
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Preferred Name | English | ||
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Common Name | English | ||
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| Code System | Code | Type | Description | ||
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11613681
Created by
admin on Mon Mar 31 19:26:07 GMT 2025 , Edited by admin on Mon Mar 31 19:26:07 GMT 2025
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PRIMARY | |||
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2L83S3XLZA
Created by
admin on Mon Mar 31 19:26:07 GMT 2025 , Edited by admin on Mon Mar 31 19:26:07 GMT 2025
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PRIMARY | |||
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844694-85-5
Created by
admin on Mon Mar 31 19:26:07 GMT 2025 , Edited by admin on Mon Mar 31 19:26:07 GMT 2025
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PRIMARY | |||
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1A00250
Created by
admin on Mon Mar 31 19:26:07 GMT 2025 , Edited by admin on Mon Mar 31 19:26:07 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> IMPURITY |