Glycochenodeoxycholic Acid

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Formula C26H43NO5
IUPAC Name 2-[[(4r)-4-[(3r,5s,7s,8r,9s,10s,13r,14r,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]pentanoyl]amino]acetic acid
Molecular Mass 449.623 g·mol−1
Heat of Formation -1245.1 ± 16.7 kJ·mol−1
Dipole Moment 5.87 ± 1.08 D
Volume 571.46 Å 3
Surface Area 442.4 Å 2
HOMO Energy -9.96 ± 0.55 eV
LUMO Energy 0.69 ± eV
Point Group Symmetry C1
InChIKey GHCZAUBVMUEKKP-RFLJZQSFSA-N
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