Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C21H29NO2 |
| Molecular Weight | 327.4605 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC[C@]12CC[C@H]3[C@@H](CCC4=C\C(CC[C@H]34)=N\O)[C@@H]1CC[C@@]2(O)C#C
InChI
InChIKey=ISHXLNHNDMZNMC-VTKCIJPMSA-N
InChI=1S/C21H29NO2/c1-3-20-11-9-17-16-8-6-15(22-24)13-14(16)5-7-18(17)19(20)10-12-21(20,23)4-2/h2,13,16-19,23-24H,3,5-12H2,1H3/b22-15+/t16-,17+,18+,19-,20-,21-/m0/s1
| Molecular Formula | C21H29NO2 |
| Molecular Weight | 327.4605 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 1 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 13:36:59 GMT 2025
by
admin
on
Wed Apr 02 13:36:59 GMT 2025
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| Record UNII |
UM2XKY25DH
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| Record Status |
Validated (UNII)
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74183-55-4
Created by
admin on Wed Apr 02 13:36:59 GMT 2025 , Edited by admin on Wed Apr 02 13:36:59 GMT 2025
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UM2XKY25DH
Created by
admin on Wed Apr 02 13:36:59 GMT 2025 , Edited by admin on Wed Apr 02 13:36:59 GMT 2025
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> IMPURITY |
The combined limits for (Z)- and (E)-17-deacetylnorgestimate are NMT 0.3%
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
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