Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | 2C12H19NO2.H2O4S |
| Molecular Weight | 516.648 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OS(O)(=O)=O.CCCCNC[C@@H](O)C1=CC=C(O)C=C1.CCCCNC[C@@H](O)C2=CC=C(O)C=C2
InChI
InChIKey=PARMADWNFXEEFC-IUWNWRFPSA-N
InChI=1S/2C12H19NO2.H2O4S/c2*1-2-3-8-13-9-12(15)10-4-6-11(14)7-5-10;1-5(2,3)4/h2*4-7,12-15H,2-3,8-9H2,1H3;(H2,1,2,3,4)/t2*12-;/m11./s1
| 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 | C12H19NO2 |
| Molecular Weight | 209.2848 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 22:27:20 GMT 2025
by
admin
on
Mon Mar 31 22:27:20 GMT 2025
|
| Record UNII |
34YO9O18CB
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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| Name | Type | Language | ||
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Preferred Name | English | ||
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Common Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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76968051
Created by
admin on Mon Mar 31 22:27:20 GMT 2025 , Edited by admin on Mon Mar 31 22:27:20 GMT 2025
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PRIMARY | |||
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34YO9O18CB
Created by
admin on Mon Mar 31 22:27:20 GMT 2025 , Edited by admin on Mon Mar 31 22:27:20 GMT 2025
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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RACEMATE -> ENANTIOMER |
