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Progesterone
CAS: 57-83-0 | C21H30O2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
57-83-0
Molecular Formula:
C21H30O2
Molecular Weight:
314.46900000000005 g/mol
Names and Synonyms:
Progesterone
Synonym
Pregn-4-ene-3,20-dione
Synonym
Progesterone
Synonym
Corlutin
Synonym
Corlutina
Synonym
Corluvite
Synonym
Corporin
Synonym
Corpus luteum hormone
Synonym
Flavolutan
Synonym
Fologenon
Synonym
Gestone
Synonym
Gestormone
Synonym
Glanducorpin
Synonym
Hormoflaveine
Synonym
Hormoluton
Synonym
Luteal Hormone
Synonym
Luteinique
Synonym
Luteodyn
Synonym
Luteogan
Synonym
Luteohormone
Synonym
Luteosan
Synonym
Luteostab
Synonym
Luteovis
Synonym
Lutex
Synonym
Lutidon
Synonym
Lutocyclin
Synonym
Lutocyclin M
Synonym
Lutocylin
Synonym
Lutoform
Synonym
Lutogyl
Synonym
Lutren
Synonym
Lutromone
Synonym
Piaponon
Synonym
Primolut
Synonym
Progekan
Synonym
Progesterol
Synonym
Progestin
Synonym
Progestone
Synonym
Prolidon
Synonym
Luteol
Synonym
Syntolutan
Synonym
Proluton
Synonym
Agolutin
Synonym
Lucorteum Sol
Synonym
Gestron
Synonym
Percutacrine Luteinique
Synonym
Lipo-Lutin
Synonym
Nalutron
Synonym
Progestron
Synonym
Luteopur
Synonym
Bio-luton
Synonym
Gynlutin
Synonym
Gynolutone
Synonym
Gesterol
Synonym
Luteocrin normale
Synonym
Syngestrets
Synonym
Prolets
Synonym
Lutin
Synonym
Lutociclina
Synonym
Protormone
Synonym
Progestasert
Synonym
Vitarrine
Synonym
Δ4-Pregnene-3,20-dione
Synonym
Utrogestan
Synonym
Luteum
Synonym
U 3672
Synonym
Crinone
Synonym
Progestogel
Synonym
Lugesteron
Synonym
Prontogest
Synonym
Prometrium
Synonym
Utrogest
Synonym
Cyclogest
Synonym
Syngesterone
Synonym
Progestol
Synonym
Gestiron
Synonym
Lutocuclin M
Synonym
Progeston
Synonym
NSC 64377
Synonym
NSC 9704
Synonym
Progeffik
Synonym
Progestan
Synonym
Duraprogen
Synonym
CIDR
Synonym
Estima
Synonym
Prochieve
Synonym
Endometrin
Synonym
Minagest
Synonym
Microgest
Synonym
Lugesterone
Synonym
EAZI-BREED CIDR
Synonym
4-Pregnene-3,20-dione
Synonym
P4
Synonym
Luteosterone
Synonym
Sincrogest
Synonym
Lutinus
Synonym
Cue-Mate
Synonym
Progeffik 200
Synonym
Identifiers:
SMILES:
CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
InChI:
InChI=1S/C21H30O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h12,16-19H,4-11H2,1-3H3/t16-,17+,18-,19-,20-,21+/m0/s1
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 314.46900000000005 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 314.2245802 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 23 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 2 count | RDKit |
| Hydrogen Bond Donors | 0 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 1 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 34.14 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | 4.723500000000005 | RDKit |
| molecular_mass | 314.47 g/mol | Legacy Database |
| density | 1.17 g/cm³ | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Progesterone None | Legacy Database |
| cas-canonical-smile | O=C1C=C2CCC3C(CCC4(C)C(C(=O)C)CCC34)C2(C)CC1 None | Legacy Database |
| cas-density | 1.166 g/cm3 @ Temp: 23 °C None | Legacy Database |
| cas-inchi | InChI=1S/C21H30O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h12,16-19H,4-11H2,1-3H3/t16-,17+,18-,19-,20-,21+/m0/s1 None | Legacy Database |
| cas-inchi-key | InChIKey=RJKFOVLPORLFTN-LEKSSAKUSA-N None | Legacy Database |
| cas-melting-point | 127-131 °C None | Legacy Database |
| cas-name | Progesterone None | Legacy Database |
| wikipedia-name | Progesterone None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 90.88100000000006 | RDKit |