4-(3,7-Dihydroxy-10,13-Dimethylhexadecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl)-2-Methylpentanoic Acid
Properties
Property | Value |
---|---|
Formula | C25H42O4 |
IUPAC Name | (2r,4r)-4-[(3r,5s,7s,8r,9s,10s,13r,14s,17r)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1h-cyclopenta[a]phenanthren-17-yl]-2-methyl-pentanoic acid |
Molecular Mass | 406.599 g·mol−1 |
Heat of Formation | -1100.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.56 ± 1.08 D |
Volume | 529.6 Å 3 |
Surface Area | 406.72 Å 2 |
HOMO Energy | -9.89 ± 0.55 eV |
LUMO Energy | 1.02 ± eV |
Point Group Symmetry | C1 |
InChIKey | XMIXAXLPZCFFCG-GOIOCUDNSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |