Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C21H23F3O5S.C6H14N2O2 |
| Molecular Weight | 590.652 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
NCCCC[C@H](N)C(O)=O.CCO[C@H](COC1=CC=C(C=C1)C(F)(F)F)CSC2=CC=C(OCC(O)=O)C(C)=C2
InChI
InChIKey=IOIAOZMQFNHRKR-FFHLUDTASA-N
InChI=1S/C21H23F3O5S.C6H14N2O2/c1-3-27-17(11-28-16-6-4-15(5-7-16)21(22,23)24)13-30-18-8-9-19(14(2)10-18)29-12-20(25)26;7-4-2-1-3-5(8)6(9)10/h4-10,17H,3,11-13H2,1-2H3,(H,25,26);5H,1-4,7-8H2,(H,9,10)/t17-;5-/m10/s1
| Molecular Formula | C6H14N2O2 |
| Molecular Weight | 146.1876 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | C21H23F3O5S |
| Molecular Weight | 444.465 |
| 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
Fri Dec 15 15:51:03 UTC 2023
by
admin
on
Fri Dec 15 15:51:03 UTC 2023
|
| Record UNII |
75US2513Z8
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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100000177202
Created by
admin on Fri Dec 15 15:51:03 UTC 2023 , Edited by admin on Fri Dec 15 15:51:03 UTC 2023
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PRIMARY | |||
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75US2513Z8
Created by
admin on Fri Dec 15 15:51:03 UTC 2023 , Edited by admin on Fri Dec 15 15:51:03 UTC 2023
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PRIMARY | |||
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15983987
Created by
admin on Fri Dec 15 15:51:03 UTC 2023 , Edited by admin on Fri Dec 15 15:51:03 UTC 2023
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928821-41-4
Created by
admin on Fri Dec 15 15:51:03 UTC 2023 , Edited by admin on Fri Dec 15 15:51:03 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE | |||
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SOLVATE->ANHYDROUS |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |