Details
Stereochemistry | RACEMIC |
Molecular Formula | C22H27NO4.ClH |
Molecular Weight | 405.915 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CN(C)C[C@H]1CCCC[C@]1(O)C2=CC(OC(=O)C3=CC=CC=C3O)=CC=C2
InChI
InChIKey=HSCWGAUDRWJNME-YITVUBHWSA-N
InChI=1S/C22H27NO4.ClH/c1-23(2)15-17-8-5-6-13-22(17,26)16-9-7-10-18(14-16)27-21(25)19-11-3-4-12-20(19)24;/h3-4,7,9-12,14,17,24,26H,5-6,8,13,15H2,1-2H3;1H/t17-,22+;/m1./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 | C22H27NO4 |
Molecular Weight | 369.4541 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:57:14 GMT 2023
by
admin
on
Fri Dec 15 15:57:14 GMT 2023
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Record UNII |
RPO5VCH456
|
Record Status |
Validated (UNII)
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Record Version |
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-
Download
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76966629
Created by
admin on Fri Dec 15 15:57:14 GMT 2023 , Edited by admin on Fri Dec 15 15:57:14 GMT 2023
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PRIMARY | |||
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RPO5VCH456
Created by
admin on Fri Dec 15 15:57:14 GMT 2023 , Edited by admin on Fri Dec 15 15:57:14 GMT 2023
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PRIMARY |
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |