Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C13H17NO19S3.4Na |
| Molecular Weight | 679.423 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 8 / 8 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].[Na+].[Na+].[Na+].[H][C@@]2(O[C@H]1[C@H](O)[C@@H](NS([O-])(=O)=O)[C@@H](OC)O[C@@H]1COS([O-])(=O)=O)OC(=C[C@H](O)[C@H]2OS([O-])(=O)=O)C([O-])=O
InChI
InChIKey=RQZKLVNMRVFKTR-XISSBKPVSA-J
InChI=1S/C13H21NO19S3.4Na/c1-28-12-7(14-34(19,20)21)8(16)10(6(31-12)3-29-35(22,23)24)32-13-9(33-36(25,26)27)4(15)2-5(30-13)11(17)18;;;;/h2,4,6-10,12-16H,3H2,1H3,(H,17,18)(H,19,20,21)(H,22,23,24)(H,25,26,27);;;;/q;4*+1/p-4/t4-,6+,7+,8+,9+,10+,12-,13-;;;;/m0..../s1
| Molecular Formula | Na |
| Molecular Weight | 22.9898 |
| Charge | 1 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C13H17NO19S3 |
| Molecular Weight | 587.464 |
| Charge | -4 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 8 / 8 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 11:01:42 GMT 2023
by
admin
on
Sat Dec 16 11:01:42 GMT 2023
|
| Record UNII |
WI32MD85KF
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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WI32MD85KF
Created by
admin on Sat Dec 16 11:01:42 GMT 2023 , Edited by admin on Sat Dec 16 11:01:42 GMT 2023
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155801585
Created by
admin on Sat Dec 16 11:01:42 GMT 2023 , Edited by admin on Sat Dec 16 11:01:42 GMT 2023
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1809833-99-5
Created by
admin on Sat Dec 16 11:01:42 GMT 2023 , Edited by admin on Sat Dec 16 11:01:42 GMT 2023
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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 |
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