2-{(4R)-4-[(5S,7R,10S,12S,13R,17R)-2,7,12-Trihydroxy-10,13-Dimethylhexadecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl]Pentyl}Pentanedioic Acid
Properties
Property | Value |
---|---|
Formula | C29H48O7 |
IUPAC Name | (2s)-2-[(4r)-4-[(2s,5s,7r,8s,9r,10s,12s,13r,14r,17r)-2,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1h-cyclopenta[a]phenanthren-17-yl]pentyl]pentanedioic acid |
Molecular Mass | 508.687 g·mol−1 |
Heat of Formation | -1653.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.18 ± 1.08 D |
Volume | 637.37 Å 3 |
Surface Area | 495.21 Å 2 |
HOMO Energy | -10.21 ± 0.55 eV |
LUMO Energy | 0.67 ± eV |
Point Group Symmetry | C1 |
InChIKey | PYDPTALDJCISIJ-YYHIAVMYSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |