Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | 2C7H7O4S.Ca |
| Molecular Weight | 414.464 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Ca++].CC1=CC(O)=CC=C1S([O-])(=O)=O.CC2=CC(O)=CC=C2S([O-])(=O)=O
InChI
InChIKey=MBXZICHWZCIYII-UHFFFAOYSA-L
InChI=1S/2C7H8O4S.Ca/c2*1-5-4-6(8)2-3-7(5)12(9,10)11;/h2*2-4,8H,1H3,(H,9,10,11);/q;;+2/p-2
| Molecular Formula | C7H7O4S |
| Molecular Weight | 187.193 |
| Charge | -1 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | Ca |
| Molecular Weight | 40.078 |
| Charge | 2 |
| 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
Sat Dec 16 10:12:26 GMT 2023
by
admin
on
Sat Dec 16 10:12:26 GMT 2023
|
| Record UNII |
UT54A5UB2I
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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UT54A5UB2I
Created by
admin on Sat Dec 16 10:12:27 GMT 2023 , Edited by admin on Sat Dec 16 10:12:27 GMT 2023
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92135712
Created by
admin on Sat Dec 16 10:12:27 GMT 2023 , Edited by admin on Sat Dec 16 10:12:27 GMT 2023
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PRIMARY |