Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C22H28NO3.CH3O4S |
| Molecular Weight | 465.56 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COS([O-])(=O)=O.C[N+]1(C)CCCC[C@@H]1COC(=O)C(O)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChIKey=AXKJGGRSAVLXTE-VEIFNGETSA-M
InChI=1S/C22H28NO3.CH4O4S/c1-23(2)16-10-9-15-20(23)17-26-21(24)22(25,18-11-5-3-6-12-18)19-13-7-4-8-14-19;1-5-6(2,3)4/h3-8,11-14,20,25H,9-10,15-17H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1/t20-;/m1./s1
| Molecular Formula | CH3O4S |
| Molecular Weight | 111.097 |
| Charge | -1 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C22H28NO3 |
| Molecular Weight | 354.4626 |
| Charge | 1 |
| Count |
|
| Stereochemistry | EPIMERIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 10:50:59 GMT 2023
by
admin
on
Sat Dec 16 10:50:59 GMT 2023
|
| Record UNII |
WP84S6H2AO
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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WP84S6H2AO
Created by
admin on Sat Dec 16 10:50:59 GMT 2023 , Edited by admin on Sat Dec 16 10:50:59 GMT 2023
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PRIMARY | |||
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76969999
Created by
admin on Sat Dec 16 10:50:59 GMT 2023 , Edited by admin on Sat Dec 16 10:50:59 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
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RACEMATE -> ENANTIOMER |
