| Formula |
C21H28O2 |
| IUPAC Name |
(8r,9s,10r,13s,14s,17r)-17-ethynyl-17-hydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1h-cyclopenta[a]phenanthren-3-one |
| Molecular Mass |
312.446 g·mol−1 |
| Heat of Formation |
-229.6 ± 16.7 kJ·mol−1 |
| Dipole Moment |
4.58 ± 1.08 D |
| Volume |
388.5 Å 3 |
| Surface Area |
301.04 Å 2 |
| HOMO Energy |
-9.73 ± 0.55 eV |
| LUMO Energy |
0.06 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- (17alpha)-17-hydroxypregn-4-en-20-yn-3-one
- (8r,9s,10r,13s,14s,17r)-17-ethynyl-17-hydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1h-cyclopenta[a]phenanthren-3-one
- 17alpha-ethynyl-17beta-hydroxyandrost-4-en-3-one
- 17alpha-ethynyltestosterone
- 17beta-hydroxy-4,17alpha-pregnen-20-yn-3-one
- 4,17alpha-pregnen-17beta-ol-20-yn-3-one
- bb_nc-0626
- bpbio1_000114
|
| CAS Number(s) |
|
| InChIKey |
CHNXZKVNWQUJIB-CEGNMAFCSA-N |
| QR Code |
Generate QR Code |
| Links |
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|
| DOI |
|
| Downloads |
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|
| Elements |
H
C
O
|
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