Formula |
C25H34O3 |
IUPAC Name |
[(8r,9s,13s,14s,17s)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] cyclohexanecarboxylate |
Molecular Mass |
382.536 g·mol−1 |
Heat of Formation |
-684.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.41 ± 1.08 D |
Volume |
480.06 Å 3 |
Surface Area |
383.35 Å 2 |
HOMO Energy |
-8.75 ± 0.55 eV |
LUMO Energy |
3.24 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- cyclohexanecarboxylic acid [(8r,9s,13s,14s,17s)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] ester
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InChIKey |
IVRCALGRJCHPRV-BZDYCCQFSA-N |
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Links |
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Elements |
H
C
O
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