(1β,3β,11Alpha)-1,3,11-Trihydroxy-7-Oxolanosta-8,24-Dien-29-Oic Acid
Properties
Property | Value |
---|---|
Formula | C30H46O6 |
IUPAC Name | (1r,3s,4r,5r,10s,11r,13r,14r,17r)-17-[(1r)-1,5-dimethylhex-4-enyl]-1,3,11-trihydroxy-4,10,13,14-tetramethyl-7-oxo-1,2,3,5,6,11,12,15,16,17-decahydrocyclopenta[a]phenanthrene-4-carboxylic acid |
Molecular Mass | 502.683 g·mol−1 |
Heat of Formation | -1341.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.38 ± 1.08 D |
Volume | 623.89 Å 3 |
Surface Area | 470.72 Å 2 |
HOMO Energy | -9.26 ± 0.55 eV |
LUMO Energy | 2.55 ± eV |
Point Group Symmetry | C1 |
InChIKey | KDPKGPAHQJHMQT-SYGGIMJSSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |