(3α,5α,7α,12α)-3,7,12-Trihydroxycholan-24-Yl Hydrogen Sulfate
Properties
Property | Value |
---|---|
Formula | C24H42O7S |
IUPAC Name | [(4r)-4-[(3r,5r,7r,8r,9s,10s,12s,13r,14s,17r)-3,7,12-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] hydrogen sulfate |
Molecular Mass | 474.651 g·mol−1 |
Heat of Formation | -1579.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.29 ± 1.08 D |
Volume | 567.19 Å 3 |
Surface Area | 442.71 Å 2 |
HOMO Energy | -10.00 ± 0.55 eV |
LUMO Energy | -0.32 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | BKZKSSHAWFCVDU-JLIFGLSWSA-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 |