(3Ar,6R,6As)-6-[(S)-(1S)-2-Cyclohexen-1-Yl(Hydroxy)Methyl]-6A-Methyl-4-Oxohexahydro-2H-Furo[2,3-C]Pyrrole-6-Carbaldehyde

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Formula C15H21NO4
IUPAC Name (3ar,6r,6as)-6-[(s)-[(1s)-cyclohex-2-en-1-yl]-hydroxy-methyl]-6a-methyl-4-oxo-2,3,3a,5-tetrahydrofuro[2,3-c]pyrrole-6-carbaldehyde
Molecular Mass 279.332 g·mol−1
Heat of Formation -687.9 ± 16.7 kJ·mol−1
Dipole Moment 3.10 ± 1.08 D
Volume 333.97 Å 3
Surface Area 279.07 Å 2
HOMO Energy -9.67 ± 0.55 eV
LUMO Energy 3.31 ± eV
Point Group Symmetry C1
Synonyms
  • (3ar,6r,6as)-6-((s)-((s)-cyclohex-2-enyl)(hydroxy)methyl)-6a-methyl-4-oxo-hexahydro-2h-furo[3,2-c]pyrrole-6-carbaldehyde
  • (3ar,6r,6as)-6-[(s)-[(1s)-1-cyclohex-2-enyl]-hydroxy-methyl]-4-keto-6a-methyl-2,3,3a,5-tetrahydrofuro[2,3-c]pyrrole-6-carbaldehyde
  • (3ar,6r,6as)-6-[(s)-[(1s)-1-cyclohex-2-enyl]-hydroxy-methyl]-6a-methyl-4-oxo-2,3,3a,5-tetrahydrofuro[2,3-c]pyrrole-6-carbaldehyde
  • (3ar,6r,6as)-6-[(s)-[(1s)-1-cyclohex-2-enyl]-hydroxymethyl]-6a-methyl-4-oxo-2,3,3a,5-tetrahydrofuro[2,3-c]pyrrole-6-carboxaldehyde
InChIKey YVABESCRHMBHJD-FUQNVFFISA-N
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