Products 53016-31-2

CAS 53016-31-2 appears in our catalog under these names: 17-Desacetyl Norgestimate (Mixture of Isomers) (Norelgestromin), (3Z)-17-Desacetyl Norgestimate, >95% (HPLC), (E/Z)-17-Deacetylnorgestimate, Norgestimate EP Impurity C, Norelgestromin (17-Deacetylnorgestimate). Offered by: Chemat Brand, TRC, Mikromol, LoGiCal, TargetMol. Available pack sizes: on request, 25mg, 100mg, 10mg, 50mg, 200mg, 5mg, 25 mg.

17-Desacetyl Norgestimate (Mixture of Isomers) (Norelgestromin)
Chemat Brand
  • size: on request
  • Variants: 1
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(3Z)-17-Desacetyl Norgestimate, >95% (HPLC)
TRC
  • size: 25mg
  • Variants: 1
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(E/Z)-17-Deacetylnorgestimate
TRC
  • size: 100mg
  • Variants: 1
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Norgestimate EP Impurity C
Mikromol
  • size: 25mg, 100mg
  • Variants: 2
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Norelgestromin (17-Deacetylnorgestimate)
LoGiCal
  • size: 10mg
  • Variants: 1
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Norgestimate metabolite Norelgestromin/ 99.25% (existing batch purity)
TargetMol
  • size: 10mg, 25mg, 50mg, 100mg
  • Variants: 5
from 465.53
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17-Desacetyl norgestimate
Biosynth
  • size: 10mg, 5mg, 25mg, 50mg
  • Variants: 5
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Norelgestromin, 99%, 99%
Chemat
  • size: 5mg, 10mg
  • Variants: 2
from 174.80
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Norgestimate metabolite Norelgestromin, 99.89%
MedChemExpress
  • size: 25 mg, 10mM/1mL, 100 mg, 5 mg
  • Variants: 6
from 384.71
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Norgestimate metabolite Norelgestromin (Standard)
MedChemExpress
  • size: 10 mg, 50 mg, 100 mg, 25 mg
  • Variants: 5
from 793.38
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17-Desacetyl Norgestimate-d7 (Mixture of Isomers) (Norelgestromin-d7)
Chemat Brand
  • size: on request
  • Variants: 1
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Structural formula: {0} (CAS {1})

(8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-3-hydroxyimino-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-ol (CAS 53016-31-2) is a chemical compound with the molecular formula C21H29NO2 and a molecular weight of 327.5 g/mol. IUPAC name: (8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-3-hydroxyimino-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-ol. InChIKey: ISHXLNHNDMZNMC-XUDSTZEESA-N.

Identity
Molecular formulaC21H29NO2
Molecular weight327.5 g/mol
IUPAC name(8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-3-hydroxyimino-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-ol
InChIKeyISHXLNHNDMZNMC-XUDSTZEESA-N
SMILESCC[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=CC(=NO)CC[C@H]34

Computed by PubChem (NCBI)

Synonyms: Norelgestromin, Levonorgestrel oxime, 17-Deacetylnorgestimate, Norplant 3-oxime, D-Norgestrel 3-oxime, 18-Methylnorethindrone oxime, Deacetylnorgestimate, 18,19-Dinorpregn-4-en-20-yn-3-one, 13-ethyl-17-hydroxy-, oxime, (17alpha)-, norelgestromine, Norelgestromina
Related forms of this compound
(3E,8R,9R,10R,13R,14S,17R)-2,2,4,6,6,10-hexadeuterio-13-ethyl-17-ethynyl-3-hydroxyimino-7,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-17-ol C21H29NO2
(3E,8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-3-hydroxyimino-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-ol C21H29NO2
Isomers (same molecular formula)
[1-(4-hydroxypentyl)indol-3-yl]-(2,2,3,3-tetramethylcyclopropyl)methanone C21H29NO2
(3R,4R)-1,1,1,2,2-pentadeuterio-5-(dimethylamino)-4-methyl-3-(3-phenylmethoxyphenyl)pentan-3-ol C21H29NO2
(1R)-1-[(1R,2S,4R)-2-bicyclo[2.2.1]hept-5-enyl]-3-(1-oxidopiperidin-1-ium-1-yl)-1-phenylpropan-1-ol C21H29NO2
(1S,9R,10S)-17-(cyclobutylmethyl)-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene-4,10-diol C21H29NO2
(1S,9R,10S)-17-(cyclobutylmethyl)-12,12,13,13,14,14-hexadeuterio-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene-4,10-diol C21H29NO2