Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C27H37Cl2NO5.C4H6O6 |
| Molecular Weight | 676.579 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O[C@H]([C@@H](O)C(O)=O)C(O)=O.CC1(C)OCC2=CC(=CC=C2O1)[C@@H](O)CNCCCCCCOCCOCC3=C(Cl)C=CC=C3Cl
InChI
InChIKey=GHDJZPJWGYFIPH-FUTSCGIJSA-N
InChI=1S/C27H37Cl2NO5.C4H6O6/c1-27(2)34-18-21-16-20(10-11-26(21)35-27)25(31)17-30-12-5-3-4-6-13-32-14-15-33-19-22-23(28)8-7-9-24(22)29;5-1(3(7)8)2(6)4(9)10/h7-11,16,25,30-31H,3-6,12-15,17-19H2,1-2H3;1-2,5-6H,(H,7,8)(H,9,10)/t25-;1-,2-/m01/s1
| Molecular Formula | C4H6O6 |
| Molecular Weight | 150.0868 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | C27H37Cl2NO5 |
| Molecular Weight | 526.492 |
| 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
Wed Apr 02 19:28:30 GMT 2025
by
admin
on
Wed Apr 02 19:28:30 GMT 2025
|
| Record UNII |
H7J9C93Z36
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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171390151
Created by
admin on Wed Apr 02 19:28:30 GMT 2025 , Edited by admin on Wed Apr 02 19:28:30 GMT 2025
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2248646-89-9
Created by
admin on Wed Apr 02 19:28:30 GMT 2025 , Edited by admin on Wed Apr 02 19:28:30 GMT 2025
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H7J9C93Z36
Created by
admin on Wed Apr 02 19:28:30 GMT 2025 , Edited by admin on Wed Apr 02 19:28:30 GMT 2025
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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![Structure of 2-[6-[2-[(2,6-dichlorophenyl)methoxy]ethoxy]hexylamino]-1-(2,2-dimethyl-4H-1,3-benzodioxin-6-yl)ethanol, (1R)-](/img/6f8d952c-fd04-41bc-8d5f-312cd2c34f24.svg "Structure of 2-[6-[2-[(2,6-dichlorophenyl)methoxy]ethoxy]hexylamino]-1-(2,2-dimethyl-4H-1,3-benzodioxin-6-yl)ethanol, (1R)-")