Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C12H22NO11S3.K |
| Molecular Weight | 491.596 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[K+].CS(=O)(=O)CCCC\C(S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=N/OS([O-])(=O)=O
InChI
InChIKey=MRWGDPZZBCERIT-DHPXDJSUSA-M
InChI=1S/C12H23NO11S3.K/c1-26(18,19)5-3-2-4-8(13-24-27(20,21)22)25-12-11(17)10(16)9(15)7(6-14)23-12;/h7,9-12,14-17H,2-6H2,1H3,(H,20,21,22);/q;+1/p-1/b13-8+;/t7-,9-,10+,11-,12+;/m1./s1
| Molecular Formula | C12H22NO11S3 |
| Molecular Weight | 452.498 |
| Charge | -1 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 1 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | K |
| Molecular Weight | 39.0983 |
| Charge | 1 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 22:30:58 GMT 2025
by
admin
on
Mon Mar 31 22:30:58 GMT 2025
|
| Record UNII |
7XH95MK74G
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| Record Status |
Validated (UNII)
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| Record Version |
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7XH95MK74G
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22149-26-4
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DTXSID40176677
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5405
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56841026
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