Details
Stereochemistry | EPIMERIC |
Molecular Formula | C20H25ClN2O5.C10H16O4S |
Molecular Weight | 641.173 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 3 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1(C)[C@@H]2CC[C@@]1(CS(O)(=O)=O)C(=O)C2.CCOC(=O)C3=C(COCCN)NC(C)=C(C3C4=C(Cl)C=CC=C4)C(=O)OC
InChI
InChIKey=UXKMFEPPKJZDAR-STOWLHSFSA-N
InChI=1S/C20H25ClN2O5.C10H16O4S/c1-4-28-20(25)18-15(11-27-10-9-22)23-12(2)16(19(24)26-3)17(18)13-7-5-6-8-14(13)21;1-9(2)7-3-4-10(9,8(11)5-7)6-15(12,13)14/h5-8,17,23H,4,9-11,22H2,1-3H3;7H,3-6H2,1-2H3,(H,12,13,14)/t;7-,10-/m.1/s1
Molecular Formula | C20H25ClN2O5 |
Molecular Weight | 408.876 |
Charge | 0 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Optical Activity | ( + / - ) |
Molecular Formula | C10H16O4S |
Molecular Weight | 232.297 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 09:24:34 UTC 2023
by
admin
on
Sat Dec 16 09:24:34 UTC 2023
|
Record UNII |
0V8DBY3260
|
Record Status |
Validated (UNII)
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Record Version |
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-
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100000127717
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SUB33804
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12991104
Created by
admin on Sat Dec 16 09:24:34 UTC 2023 , Edited by admin on Sat Dec 16 09:24:34 UTC 2023
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0V8DBY3260
Created by
admin on Sat Dec 16 09:24:34 UTC 2023 , Edited by admin on Sat Dec 16 09:24:34 UTC 2023
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652969-01-2
Created by
admin on Sat Dec 16 09:24:34 UTC 2023 , Edited by admin on Sat Dec 16 09:24:34 UTC 2023
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
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Related Record | Type | Details | ||
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ACTIVE MOIETY |
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