2-{[(3α,5Beta,7α,8Xi,9Xi,14Xi)-7-Hydroxy-24-Oxo-3-(Sulfooxy)Cholan-24-Yl]Amino}Ethanesulfonic Acid
Properties
Property | Value |
---|---|
Formula | C26H45NO9S2 |
IUPAC Name | 2-[[(4r)-4-[(3r,5r,7r,8r,9s,10s,13r,14s,17r)-7-hydroxy-3-hydroxysulfonyloxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1h-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonic acid |
Molecular Mass | 579.767 g·mol−1 |
Heat of Formation | 1885.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.84 ± 1.08 D |
Volume | 531.05 Å 3 |
Surface Area | 462.6 Å 2 |
Point Group Symmetry | C1 |
InChIKey | GLVWZDCWCRWVFM-MHZDSMCQSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
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Elements | C S O N |