Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C20H26O2 |
Molecular Weight | 298.4192 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 6 / 6 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@@]12CC[C@@](O)(C#C)[C@@]1(C)CC[C@]3([H])[C@@]4([H])CCC(=O)C=C4CC[C@@]23[H]
InChI
InChIKey=VIKNJXKGJWUCNN-XGXHKTLJSA-N
InChI=1S/C20H26O2/c1-3-20(22)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,12,15-18,22H,4-11H2,2H3/t15-,16+,17+,18-,19-,20-/m0/s1
Molecular Formula | C20H26O2 |
Molecular Weight | 298.4192 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 6 / 6 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:09:50 UTC 2023
by
admin
on
Fri Dec 15 15:09:50 UTC 2023
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Record UNII |
T18F433X4S
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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NDF-RT |
N0000175602
Created by
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WHO-ESSENTIAL MEDICINES LIST |
18.3.1 (ETH/NOR)
Created by
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NCI_THESAURUS |
C776
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LIVERTOX |
696
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WHO-VATC |
QG03AA05
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WHO-VATC |
QG03AC01
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NDF-RT |
N0000011301
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WHO-ATC |
G03AC01
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WHO-VATC |
QG03FA01
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WHO-ATC |
G03FA01
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WHO-VATC |
QG03AB04
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WHO-ATC |
G03FB05
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WHO-VATC |
QG03DC02
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WHO-ATC |
G03DC02
Created by
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WHO-VATC |
QG03FB05
Created by
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WHO-ATC |
G03AA05
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WHO-ATC |
G03AB04
Created by
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Code System | Code | Type | Description | ||
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9564
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PRIMARY | |||
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SUB09362MIG
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2880
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PRIMARY | |||
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NORETHINDRONE
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PRIMARY | Description: A white or creamy white, crystalline powder; odourless. Solubility: Practically insoluble in water; soluble in 150 parts of ethanol (~750 g/l) TS and in 80 parts of acetone R. Category: Progestational steroid. Storage: Norethisterone should be kept in a well-closed container, protected from light.Definition: Norethisterone contains not less than 97.0% and not more than 103.0% of C20H26O2, calculated with reference to thedried substance. | ||
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6230
Created by
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PRIMARY | |||
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T18F433X4S
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PRIMARY | |||
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1962
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1469005
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3370
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PRIMARY | |||
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SUB87911
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PRIMARY | |||
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T18F433X4S
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PRIMARY | |||
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D009640
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PRIMARY | |||
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7514
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PRIMARY | RxNorm | ||
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100000092090
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PRIMARY | |||
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C62059
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CHEMBL1162
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PRIMARY | |||
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m8056
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PRIMARY | Merck Index | ||
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200-681-6
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687
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DTXSID9023380
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DB00717
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Norethindrone
Created by
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PRIMARY | |||
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68-22-4
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NORETHISTERONE
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7627
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PRIMARY |
Related Record | Type | Details | ||
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METABOLITE LESS ACTIVE -> PARENT |
Relative Binding Affinity (RBA) to Human Progesterone receptor (cytosol of human breast MCF-7 cells); Unit: % (relative to Org-2058 (=100%)); Norethindrone was 21.5%
IN-VITRO
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METABOLITE INACTIVE -> PARENT |
Unit: ng/mL; 1mg (w/50mcg mestranol) q.d. oral administration; analyzed on the 7th, 14th, and 21st days (two females)
IN-VIVO
PLASMA
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|
PARENT -> METABOLITE |
Metabolite to parent drug ratio in non-uraemic human plasma.
Norethynodrel is metabolized in man to the antifertility agent norethisterone(norethindrone).
METABOLITE TO PARENT DRUG RATIO
PLASMA; URINE
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METABOLITE INACTIVE -> PARENT |
Unit: ng/mL; 25mg single oral administration (one woman); blood was obtained 3hr after ingestion
IN-VIVO
PLASMA
|
||
|
METABOLITE INACTIVE -> PARENT |
Unit: ng/mL; 25mg single oral administration (one woman); blood was obtained 3hr after ingestion
IN-VIVO
PLASMA
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||
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METABOLITE INACTIVE -> PARENT |
Unit: ng/mL; 3hr after 25mg single oral administration
IN-VIVO
PLASMA
|
||
|
METABOLITE INACTIVE -> PARENT |
IN-VIVO
PLASMA
|
||
|
METABOLITE INACTIVE -> PARENT |
Unit: ng/mL (expressed as a mixture of the 3- (predominant) and 17-sulfate); 1mg (w/50mcg mestranol) q.d. oral administration; analyzed on the 7th, 14th, and 21st days (two females)
IN-VIVO
PLASMA
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||
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METABOLITE LESS ACTIVE -> PARENT |
Unit: ng/ml; 25mg single oral administration (one female); blood was obtained 3hr after the oral ingestion
IN-VIVO
PLASMA
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METABOLITE INACTIVE -> PARENT |
unit: ng/mL; 25mg single oral administration; blood sampled after 3hr
IN-VIVO
PLASMA
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METABOLITE INACTIVE -> PARENT |
IN-VIVO
PLASMA
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METABOLITE INACTIVE -> PARENT |
Unit: mcg/24hr; 1mg (w/50mcg mestranol) q.d. oral administration; analyzed on the 7th, 14th, and 21st days (two females)
IN-VIVO
URINE
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METABOLITE INACTIVE -> PARENT |
IN-VIVO
PLASMA
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METABOLITE INACTIVE -> PARENT |
unit: mcg/24h; 1mg q.d. oral administration (w/50mcg estranol); blood sampled on the 7th, 14th, and 21st days (two females)
IN-VIVO
URINE
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||
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METABOLITE INACTIVE -> PARENT |
Unit: ng/mL; 25mg single oral administration (one woman); blood was obtained 3hr after ingestion
IN-VIVO
PLASMA
|
||
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METABOLITE LESS ACTIVE -> PARENT |
Trace amount; Unit: mcg in a urine pool (2.5% aliquot from each of 4days of urine); 25mg q.d. oral administration (one woman)
IN-VIVO
URINE
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||
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METABOLITE INACTIVE -> PARENT |
IN-VIVO
PLASMA
|
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METABOLITE INACTIVE -> PARENT |
Unit: ng/mL; 2mg (w/0.1mg mestranol) q.d. oral administration; blood was taken 3hr after the tenth pill ingestion on day 14 of the cycle (one woman)
IN-VIVO
PLASMA
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METABOLITE INACTIVE -> PARENT |
Unit: mcg/24hr; 1mg (w/50mgg mestranol) q.d. oral administration sampled on the 7th, 14th, and 21st days (two females)
IN-VIVO
URINE
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METABOLITE INACTIVE -> PARENT |
IN-VIVO
URINE
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||
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METABOLITE INACTIVE -> PARENT |
Unit: mcg/24hr; 1mg (w/50mcg mestranol) q.d. oral administration; analyzed on the 7th, 14th, and 21st days (two females)
IN-VIVO
URINE
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||
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METABOLITE INACTIVE -> PARENT |
<2 to 12; Unit: ng/mL; 1mg (50mcg mestranol) q.d. oral administration; analyzed on the 7th, 14th, and 21st days (two females)
IN-VIVO
PLASMA
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METABOLITE INACTIVE -> PARENT |
IN-VIVO
URINE
|
||
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METABOLITE INACTIVE -> PARENT |
Unit: ng/mL; 1mg (w/50mcg mestranol) q.d. oral administration; analyzed on the 7th, 14th, and 21st days (two females)
IN-VIVO
PLASMA
|
||
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METABOLITE INACTIVE -> PARENT |
Unit: mcg/24hr; 1mg (w/50mcg mestranol) q.d. oral administration; analyzed on the 7th, 14th, and 21st days (two females)
IN-VIVO
URINE
|
||
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METABOLITE INACTIVE -> PARENT |
IN-VIVO
URINE
|
||
|
METABOLITE INACTIVE -> PARENT |
Unit: ng/mL; 1mg (w/50mcg mestranol) q.d. oral administration sampled on the 7th, 14th, and 21st days (two females)
IN-VIVO
PLASMA
|
||
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METABOLITE INACTIVE -> PARENT |
<2; Unit: mcg/24hr; 1mg (50mcg mestranol) q.d. oral administration; analyzed on the 7th, 14th, and 21st days (two females)
IN-VIVO
URINE
|
||
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METABOLITE INACTIVE -> PARENT |
Unit: mcg in pooled urine (2.5% aliquot from each of the 4 days urine); 25mg q.d. oral administration for 4 days (one woman)
IN-VIVO
URINE
|
||
|
METABOLITE INACTIVE -> PARENT |
Unit: ng/mL; 1mg (w/50mcg mestranol) q.d. oral administration sampled on the 7th, 14th, and 21st days (two females)
IN-VIVO
URINE
|
||
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METABOLITE INACTIVE -> PARENT |
Unit: ng/ml; 2mg (w/0.1mg mestranol) q.d. oral administration (one woman); blood was taken 3hr after ingestion of the tenth pill on day 14 of the cycle
IN-VIVO
PLASMA
|
||
|
METABOLITE INACTIVE -> PARENT |
Unit: mcg in a urine pool (2.5% aliquot from each of 4 days of urine); 25mg q.d. oral administration for 4 days
IN-VIVO
URINE
|
||
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METABOLITE LESS ACTIVE -> PARENT |
Unit: ng/mL; 2mg (w/0.1mg mestranol) q.d. oral administration; blood was obtained 3hr after the tenth pill administration on day 14 of the cycle
IN-VIVO
PLASMA
|
||
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METABOLITE INACTIVE -> PARENT |
Unit: ng/mL; 1mg (50mcg mestranol) q.d. oral administration; analyzed on the 7th, 14th, and 21st days (two females)
IN-VIVO
PLASMA
|
||
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METABOLITE INACTIVE -> PARENT |
Unit: ng/mL; 1mg (w/50mcg mestranol) q.d. oral administration; analyzed on the 7th, 14th, and 21st days (two females)
IN-VIVO
PLASMA
|
||
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METABOLITE INACTIVE -> PARENT |
IN-VIVO
URINE
|
||
|
METABOLITE INACTIVE -> PARENT |
IN-VIVO
URINE
|
||
|
METABOLITE INACTIVE -> PARENT |
<2; Unit: mcg/24hr; 1mg (50mcg mestranol) q.d. oral administration; analyzed on the 7th, 14th, and 21st days (two females)
IN-VIVO
URINE
|
Related Record | Type | Details | ||
---|---|---|---|---|
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
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PARENT -> IMPURITY |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
||
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PARENT -> IMPURITY |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
||
|
IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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||
|
IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
||
|
IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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||
|
IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
||
|
IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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||
|
IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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Related Record | Type | Details | ||
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ACTIVE MOIETY |
Name | Property Type | Amount | Referenced Substance | Defining | Parameters | References |
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Biological Half-life | PHARMACOKINETIC |
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Elimination PHARMACOKINETIC |
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Volume of Distribution | PHARMACOKINETIC |
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