(1S,3R,5Z,7E,17α,20S,23S)-1,3-Dihydroxy-23,26-Epoxy-9,10-Secocholesta-5,7,10,25(27)-Tetraen-26-One
Properties
Property | Value |
---|---|
Formula | C27H38O4 |
IUPAC Name | (5s)-5-[(2s)-2-[(1r,3as,4e,7ar)-4-[(2z)-2-[(3s,5r)-3,5-dihydroxy-2-methylene-cyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1h-inden-1-yl]propyl]-3-methylene-tetrahydrofuran-2-one |
Molecular Mass | 426.588 g·mol−1 |
Heat of Formation | -709.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.62 ± 1.08 D |
Volume | 555.52 Å 3 |
Surface Area | 437.34 Å 2 |
HOMO Energy | -8.57 ± 0.55 eV |
LUMO Energy | 2.73 ± eV |
Point Group Symmetry | C1 |
InChIKey | SAODSJHDCZTVAT-HPNZEMCUSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |