Dht2

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Properties Simple | Detailed

Formula C28H46O
IUPAC Name (1s,3e,4s)-3-[(2e)-2-[(1r,3as,7ar)-7a-methyl-1-[(e,1r,4r)-1,4,5-trimethylhex-2-enyl]-2,3,3a,5,6,7-hexahydro-1h-inden-4-ylidene]ethylidene]-4-methyl-cyclohexanol
Molecular Mass 398.664 g·mol−1
Heat of Formation -413.3 ± 16.7 kJ·mol−1
Dipole Moment 1.98 ± 1.08 D
Volume 571.58 Å 3
Surface Area 454.05 Å 2
HOMO Energy -8.44 ± 0.55 eV
LUMO Energy 0.43 ± eV
Point Group Symmetry C1
Synonyms
  • (1s,3e,4s)-3-[(2e)-2-[(1r,3as,7ar)-1-[(e,2r,5r)-5,6-dimethylhept-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1h-inden-4-ylidene]ethylidene]-4-methyl-cyclohexan-1-ol
  • (1s,3e,4s)-3-[(2e)-2-[(1r,3as,7ar)-1-[(e,2r,5r)-5,6-dimethylhept-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1h-inden-4-ylidene]ethylidene]-4-methylcyclohexan-1-ol
  • (1s,3e,4s)-3-[(2e)-2-[(1r,3as,7ar)-7a-methyl-1-[(e,1r,4r)-1,4,5-trimethylhex-2-enyl]-2,3,3a,5,6,7-hexahydro-1h-inden-4-ylidene]ethylidene]-4-methyl-1-cyclohexanol
  • (1s,3e,4s)-3-[(2e)-2-[(1r,3as,7ar)-7a-methyl-1-[(e,1r,4r)-1,4,5-trimethylhex-2-enyl]-2,3,3a,5,6,7-hexahydro-1h-inden-4-ylidene]ethylidene]-4-methyl-cyclohexan-1-ol
  • (3s,5e,7e,10s,22e)-9,10-secoergosta-5,7,22-trien-3-ol
  • (5e,7e,22e)-(3s,10s)-9,10-seco-5,7,22-ergostatrien-3-ol
  • dihydrotachysterol_2 / (5e)-(10s)-10,19-dihydrovitamin d2 / (5e)-(10s)-10,19-dihydroergocalciferol
  • lmst03010056
InChIKey ILYCWAKSDCYMBB-OPCMSESCSA-N
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