Salinosporamide B

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Properties Simple | Detailed

Formula C15H21NO4
IUPAC Name (1s,2r,5r)-5-[(s)-[(1s)-cyclohex-2-en-1-yl]-hydroxy-methyl]-2-ethyl-1-methyl-7-oxa-4-azabicyclo[3.2.0]heptane-3,6-dione
Molecular Mass 279.332 g·mol−1
Heat of Formation -663.4 ± 16.7 kJ·mol−1
Dipole Moment 4.10 ± 1.08 D
Volume 334.02 Å 3
Surface Area 282.22 Å 2
HOMO Energy -9.82 ± 0.55 eV
LUMO Energy 0.49 ± eV
Point Group Symmetry C1
Synonyms
  • (1r,4r,5s)-1-[(s)-[(1s)-1-cyclohex-2-enyl]-hydroxy-methyl]-4-ethyl-5-methyl-6-oxa-2-azabicyclo[3.2.0]heptane-3,7-dione
  • (1r,4r,5s)-1-[(s)-[(1s)-1-cyclohex-2-enyl]-hydroxy-methyl]-4-ethyl-5-methyl-6-oxa-2-azabicyclo[3.2.0]heptane-3,7-quinone
  • (1r,4r,5s)-1-[(s)-[(1s)-1-cyclohex-2-enyl]-hydroxymethyl]-4-ethyl-5-methyl-6-oxa-2-azabicyclo[3.2.0]heptane-3,7-dione
  • (1r,4r,5s)-4-ethyl-1-((s)-((s)-cyclohex-2-enyl)(hydroxy)methyl)-5-methyl-6-oxa-2-azabicyclo[3.2.0]heptane-3,7-dione
InChIKey SCJZQKFFYIGMCI-SHTIJGAHSA-N
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