(2S,2'R)-2,2'-[(2R,2'S,2''S,5R,5'R,5''S)-2,2''-Dimethyldodecahydro-2,2':5',2''-Terfuran-5,5''-Diyl]Bis(6-Methyl-5-Hepten-2-Ol)

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Properties Simple | Detailed

Formula C30H52O5
IUPAC Name (2r)-2-[(2s,5s)-5-[(2r,5s)-5-[(2r,5r)-5-[(1s)-1-hydroxy-1,5-dimethyl-hex-4-enyl]-2-methyl-tetrahydrofuran-2-yl]tetrahydrofuran-2-yl]-5-methyl-tetrahydrofuran-2-yl]-6-methyl-hept-5-en-2-ol
Molecular Mass 492.731 g·mol−1
Heat of Formation -1245.7 ± 16.7 kJ·mol−1
Dipole Moment 1.96 ± 1.08 D
Volume 667.38 Å 3
Surface Area 522.76 Å 2
HOMO Energy -9.08 ± 0.55 eV
LUMO Energy 1.34 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[(2r,5r)-5-[(2s,5r)-5-[(2s,5s)-5-[(1r)-1-hydroxy-1,5-dimethyl-hex-4-enyl]-2-methyl-tetrahydrofuran-2-yl]tetrahydrofuran-2-yl]-5-methyl-tetrahydrofuran-2-yl]-6-methyl-hept-5-en-2-ol
  • (2s)-2-[(2r,5r)-5-[(2s,5r)-5-[(2s,5s)-5-[(1r)-1-hydroxy-1,5-dimethylhex-4-enyl]-2-methyl-2-tetrahydrofuranyl]-2-tetrahydrofuranyl]-5-methyl-2-tetrahydrofuranyl]-6-methylhept-5-en-2-ol
  • (2s)-2-[(2r,5r)-5-[(2s,5r)-5-[(2s,5s)-5-[(2r)-2-hydroxy-6-methyl-hept-5-en-2-yl]-2-methyl-oxolan-2-yl]oxolan-2-yl]-5-methyl-oxolan-2-yl]-6-methyl-hept-5-en-2-ol
  • (2s)-2-[(2r,5r)-5-[(2s,5r)-5-[(2s,5s)-5-[(2r)-2-hydroxy-6-methylhept-5-en-2-yl]-2-methyloxolan-2-yl]oxolan-2-yl]-5-methyloxolan-2-yl]-6-methylhept-5-en-2-ol
CAS Number(s)
  • 96304-92-6
InChIKey LICDBSWLYVFNPL-DSIUGFRJSA-N
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