(5β,25R)-Spirostan-3-One
Properties
| Property | Value |
|---|---|
| Formula | C27H42O3 |
| IUPAC Name | (1r,2s,4s,5'r,6r,7s,8r,9s,12s,13s,18r)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-tetrahydropyran]-16-one |
| Molecular Mass | 414.621 g·mol−1 |
| Heat of Formation | -823.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.80 ± 1.08 D |
| Volume | 535.04 Å 3 |
| Surface Area | 410.74 Å 2 |
| HOMO Energy | -9.69 ± 0.55 eV |
| LUMO Energy | 1.04 ± eV |
| Point Group Symmetry | C1 |
| Synonyms |
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| CAS Number(s) |
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| InChIKey | CIBAPVLFORANSS-OBOJVYGLSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |