(3R,4S,5S,6R)-5-Methoxy-4-[(2R,3R)-2-Methyl-3-(3-Methyl-2-Buten-1-Yl)-2-Oxiranyl]-1-Oxaspiro[2.5]Oct-6-Yl Carbamate

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Properties Simple | Detailed

Formula C17H27NO5
IUPAC Name [(3r,4s,5s,6r)-5-methoxy-4-[(2r,3r)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] carbamate
Molecular Mass 325.400 g·mol−1
Heat of Formation -743.3 ± 16.7 kJ·mol−1
Dipole Moment 3.77 ± 1.08 D
Volume 406.45 Å 3
Surface Area 329.5 Å 2
HOMO Energy -9.51 ± 0.55 eV
LUMO Energy 1.02 ± eV
Point Group Symmetry C1
Synonyms
  • (3r-(3alpha,4alpha(2r*,3r*),5beta,6beta))-5-methoxy-4-(2-methyl-3-(3-methyl-2-butenyl)oxiranyl)-1-oxaspiro(2.5)octan-6-ol carbamate
  • 1-oxaspiro(2.5)octan-6-ol, 5-methoxy-4-(2-methyl-3-(3-methyl-2-butenyl)oxiranyl)-, carbamate, (3r-(3alpha,4alpha(2r*,3r*),5beta,6beta))-
  • [(3r,4s,5s,6r)-5-methoxy-4-[(2r,3r)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] carbamate
  • agm 1883
  • agm-1883
  • carbamic acid [(3r,4s,5s,6r)-5-methoxy-4-[(2r,3r)-2-methyl-3-(3-methylbut-2-enyl)-2-oxiranyl]-1-oxaspiro[2.5]octan-6-yl] ester
  • carbamic acid [(3r,4s,5s,6r)-5-methoxy-4-[(2r,3r)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] ester
CAS Number(s)
  • 129299-06-5
InChIKey DBJJYYOGHACTNG-HGDXVPPDSA-N
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