Depudecin

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Properties Simple | Detailed

Formula C11H16O4
IUPAC Name (1r)-1-[(2s,3s)-3-[(e)-2-[(2s,3s)-3-[(1r)-1-hydroxyethyl]oxiran-2-yl]vinyl]oxiran-2-yl]prop-2-en-1-ol
Molecular Mass 212.242 g·mol−1
Heat of Formation -385.0 ± 16.7 kJ·mol−1
Dipole Moment 0.53 ± 1.08 D
Volume 274.15 Å 3
Surface Area 260.29 Å 2
HOMO Energy -10.07 ± 0.55 eV
LUMO Energy -0.12 ± eV
Point Group Symmetry C1
Synonyms
  • (−)-depudecin
  • (1r)-1-[(2s,3s)-3-[(e)-2-[(2s,3s)-3-(1-hydroxyethyl)-2-oxiranyl]vinyl]-2-oxiranyl]prop-2-en-1-ol
  • (1r)-1-[(2s,3s)-3-[(e)-2-[(2s,3s)-3-(1-hydroxyethyl)oxiran-2-yl]ethenyl]oxiran-2-yl]prop-2-en-1-ol
  • (1r)-1-[(2s,3s)-3-[(e)-2-[(2s,3s)-3-(1-hydroxyethyl)oxiran-2-yl]vinyl]oxiran-2-yl]prop-2-en-1-ol
  • 4,5:8,9-dianhydro-1,2,6,7,11-pentadeoxy-d-threo-d-ido-undeca-1,6-dienitol
  • hdinhib_000060
  • smp2_000165
InChIKey DLVJMFOLJOOWFS-INMLLLKOSA-N
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Elements H C O