(1S,4S,7S,9β,23R)-7-Methoxy-9,10,14-Trimethyl-4,9-Cyclo-9,10-Secocholesta-5,24-Diene-1,23-Diol
Properties
Property | Value |
---|---|
Formula | C31H52O3 |
IUPAC Name | (3s,7s,8r,9s,10s,13r,14s,17r)-17-[(1r,3r)-3-hydroxy-1,5-dimethyl-hex-4-enyl]-7-methoxy-4,4,9,13,14-pentamethyl-2,3,7,8,10,11,12,15,16,17-decahydro-1h-cyclopenta[a]phenanthren-3-ol |
Molecular Mass | 472.743 g·mol−1 |
Heat of Formation | -816.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.89 ± 1.08 D |
Volume | 636.27 Å 3 |
Surface Area | 470.67 Å 2 |
HOMO Energy | -9.34 ± 0.55 eV |
LUMO Energy | 1.05 ± eV |
Point Group Symmetry | C1 |
InChIKey | MTYMFIWYWSHNSU-NLUPGCNDSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |