Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C17H19ClN2S.C6H8O6 |
Molecular Weight | 494.988 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@@]1(OC(=O)C(O)=C1O)[C@@H](O)CO.CN(C)CCCN2C3=CC(Cl)=CC=C3SC4=C2C=CC=C4
InChI
InChIKey=HPAVYPYIWVCLSG-MGMRMFRLSA-N
InChI=1S/C17H19ClN2S.C6H8O6/c1-19(2)10-5-11-20-14-6-3-4-7-16(14)21-17-9-8-13(18)12-15(17)20;7-1-2(8)5-3(9)4(10)6(11)12-5/h3-4,6-9,12H,5,10-11H2,1-2H3;2,5,7-10H,1H2/t;2-,5+/m.0/s1
Molecular Formula | C17H19ClN2S |
Molecular Weight | 318.864 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C6H8O6 |
Molecular Weight | 176.1241 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 18:07:37 GMT 2023
by
admin
on
Fri Dec 15 18:07:37 GMT 2023
|
Record UNII |
46995AIA65
|
Record Status |
Validated (UNII)
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Record Version |
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-
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DTXSID00231958
Created by
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82678-20-4
Created by
admin on Fri Dec 15 18:07:38 GMT 2023 , Edited by admin on Fri Dec 15 18:07:38 GMT 2023
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46995AIA65
Created by
admin on Fri Dec 15 18:07:38 GMT 2023 , Edited by admin on Fri Dec 15 18:07:38 GMT 2023
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54683198
Created by
admin on Fri Dec 15 18:07:38 GMT 2023 , Edited by admin on Fri Dec 15 18:07:38 GMT 2023
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PARENT -> SALT/SOLVATE |