(25R)-3-Oxocholest-4-En-26-Oic Acid
Properties
Property | Value |
---|---|
Formula | C27H42O3 |
IUPAC Name | (2r,6r)-6-[(8s,9s,10r,13r,14s,17r)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-heptanoic acid |
Molecular Mass | 414.621 g·mol−1 |
Heat of Formation | -826.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.16 ± 1.08 D |
Volume | 551.76 Å 3 |
Surface Area | 441.32 Å 2 |
HOMO Energy | -9.74 ± 0.55 eV |
LUMO Energy | 3.04 ± eV |
Point Group Symmetry | C1 |
InChIKey | PSXQJZDFWDKBIP-MNVVPKPGSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |