(2α,3Beta,5α,6Beta,25R)-Spirostan-2,3,6-Triol
Properties
Property | Value |
---|---|
Formula | C27H44O5 |
IUPAC Name | (1r,2s,4s,5'r,6r,7s,8r,9s,12s,13r,15r,16r,18s,19r)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-tetrahydropyran]-15,16,19-triol |
Molecular Mass | 448.635 g·mol−1 |
Heat of Formation | -1221.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.57 ± 1.08 D |
Volume | 561.52 Å 3 |
Surface Area | 427.57 Å 2 |
HOMO Energy | -9.82 ± 0.55 eV |
LUMO Energy | 2.18 ± eV |
Point Group Symmetry | C1 |
InChIKey | FYRLHXNMINIDCB-LEGLVIAUSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |