chempirical

Nomegestrol acetate

C23H30O4CAS 58652-20-3370.49 g/mol

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AlkeneEsterKetone

Properties

Molecular formula
C23H30O4
Molar mass
370.49 g/mol
Exact mass
370.2144 Da
logP
4.19Crippen estimate
Polar surface area
60.4 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
2
Stereocentres
R, S, S, R, S, Sin SMILES atom order

Identifiers

CAS number
58652-20-3
SMILES
CC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3C=C(C)C4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C
InChIKey
IIVBFTNIGYRNQY-YQLZSBIMSA-N
InChI
InChI=1S/C23H30O4/c1-13-11-20-18(17-6-5-16(26)12-19(13)17)7-9-22(4)21(20)8-10-23(22,14(2)24)27-15(3)25/h11-12,17-18,20-21H,5-10H2,1-4H3/t17-,18-,20-,21+,22+,23+/m1/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

8 names
  • 19-Norpregna-4,6-diene-3,20-dione, 17-(acetyloxy)-6-methyl-
  • 17-(Acetyloxy)-6-methyl-19-norpregna-4,6-diene-3,20-dione
  • 6-Methyl-17α-acetoxy-δ6-19-norprogesterone
  • TX 066
  • Lutenyl
  • Uniplant
  • Surplant
  • Org 10486-0

Work with Nomegestrol acetate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Nomegestrol58691-88-671 % similar Megestrol acetate595-33-568 % similar Chlormadinone acetate302-22-759 % similar 17-Acetoxyisopregn-4-ene-3,20-dione17308-02-058 % similar Progesterone acetate302-23-858 % similar Medroxyprogesterone acetate71-58-955 % similar Cyproterone acetate427-51-049 % similar Melengestrol acetate2919-66-647 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Nestorone7759-35-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook