(5β,8Alpha,9β,10Alpha,12Alpha,15β)-15-Hydroxy-17-[(R)-Methylsulfinyl]Atisan-18-Oic Acid
Properties
Property | Value |
---|---|
Formula | C21H34O4S |
IUPAC Name | (5beta,8alpha,9beta,10alpha,12alpha,15beta)-15-hydroxy-17-[(r)-methylsulfinyl]atisan-18-oic acid |
Molecular Mass | 382.557 g·mol−1 |
Heat of Formation | -923.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.17 ± 1.08 D |
Volume | 458.2 Å 3 |
Surface Area | 349.45 Å 2 |
HOMO Energy | -8.92 ± 0.55 eV |
LUMO Energy | 0.88 ± eV |
Point Group Symmetry | C1 |
InChIKey | RSTMEZAVUUMLEO-MHTDZZFBSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H S C O |