14-Demethyllanosterol

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Properties Simple | Detailed

Formula C29H48O
IUPAC Name (3s,5r,10s,13r,14r,17r)-17-[(1r)-1,5-dimethylhex-4-enyl]-4,4,10,13-tetramethyl-1,2,3,5,6,7,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ol
Molecular Mass 412.691 g·mol−1
Heat of Formation -480.1 ± 16.7 kJ·mol−1
Dipole Moment 1.52 ± 1.08 D
Volume 575.18 Å 3
Surface Area 424.14 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy 1.38 ± eV
Point Group Symmetry C1
Synonyms
  • (3beta,5alpha)-4,4-dimethylcholesta-8,24-dien-3-ol
  • (3s,5r,10s,13r,14r,17r)-17-[(1r)-1,5-dimethylhex-4-enyl]-4,4,10,13-tetramethyl-1,2,3,5,6,7,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ol
  • (3s,5r,10s,13r,14r,17r)-4,4,10,13-tetramethyl-17-[(2r)-6-methylhept-5-en-2-yl]-1,2,3,5,6,7,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ol
  • 4,4-dimethyl-5-alpha-cholesta-(8,24)-dien-3-beta-ol
  • 4,4-dimethylzymosterol
  • cholesta-8,24-dien-3-ol, 4,4-dimethyl-, (3beta,5alpha)-
CAS Number(s)
  • 7448-02-4
InChIKey CHGIKSSZNBCNDW-QGBOJXOESA-N
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