Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | 2C16H24NO5.O4S.5H2O |
| Molecular Weight | 806.87 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 2 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.O.O.O.[O-]S([O-])(=O)=O.COC1=CC(\C=C\C(=O)OCC[N+](C)(C)C)=CC(OC)=C1O.COC2=CC(\C=C\C(=O)OCC[N+](C)(C)C)=CC(OC)=C2O
InChI
InChIKey=LGEQNCIAKLLIRC-UHFFFAOYSA-N
InChI=1S/2C16H23NO5.H2O4S.5H2O/c2*1-17(2,3)8-9-22-15(18)7-6-12-10-13(20-4)16(19)14(11-12)21-5;1-5(2,3)4;;;;;/h2*6-7,10-11H,8-9H2,1-5H3;(H2,1,2,3,4);5*1H2
| Molecular Formula | C16H24NO5 |
| Molecular Weight | 310.3655 |
| Charge | 1 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Optical Activity | NONE |
| Molecular Formula | H2O4S |
| Molecular Weight | 98.078 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | H2O |
| Molecular Weight | 18.0153 |
| Charge | 0 |
| 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 14:05:34 GMT 2023
by
admin
on
Sat Dec 16 14:05:34 GMT 2023
|
| Record UNII |
PTS7VI35BD
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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| Code System | Code | Type | Description | ||
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6509-39-3
Created by
admin on Sat Dec 16 14:05:34 GMT 2023 , Edited by admin on Sat Dec 16 14:05:34 GMT 2023
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PRIMARY | |||
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133082955
Created by
admin on Sat Dec 16 14:05:34 GMT 2023 , Edited by admin on Sat Dec 16 14:05:34 GMT 2023
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PRIMARY | |||
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PTS7VI35BD
Created by
admin on Sat Dec 16 14:05:34 GMT 2023 , Edited by admin on Sat Dec 16 14:05:34 GMT 2023
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PRIMARY | |||
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m9949
Created by
admin on Sat Dec 16 14:05:34 GMT 2023 , Edited by admin on Sat Dec 16 14:05:34 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> SALT/SOLVATE | |||
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ANHYDROUS->SOLVATE |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |