1-Hydroxy-2,3-Dimethoxy-6-[(2Z,5Z,7Z,9S,10S,11Z)-10-Methoxy-3,7,9,11-Tetramethyl-2,5,7,11-Tridecatetraen-1-Yl]-5-Methyl-4(1H)-Pyridinone

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Properties Simple | Detailed

Formula C26H44NO5+
IUPAC Name 1-hydroxy-2,3-di(methoxy)-6-[(2z,5z,7z,9s,10s,11z)-10-methoxy-3,7,9,11-tetramethyl-trideca-2,5,7,11-tetraenyl]-5-methyl-piperidine-2,3,5,6-tetraid-4-one
Molecular Mass 450.631 g·mol−1
Heat of Formation -607.4 ± 16.7 kJ·mol−1
Dipole Moment 6.92 ± 1.08 D
Volume 581.1 Å 3
Surface Area 431.69 Å 2
HOMO Energy -8.24 ± 0.55 eV
LUMO Energy 2.77 ± eV
Point Group Symmetry C1
Synonyms
  • 1-hydroxy-2,3-dimethoxy-6-[(2z,5z,7z,9s,10s,11z)-10-methoxy-3,7,9,11-tetramethyl-trideca-2,5,7,11-tetraenyl]-5-methyl-4-pyridone
  • 1-hydroxy-2,3-dimethoxy-6-[(2z,5z,7z,9s,10s,11z)-10-methoxy-3,7,9,11-tetramethyl-trideca-2,5,7,11-tetraenyl]-5-methyl-pyridin-4-one
  • 1-hydroxy-2,3-dimethoxy-6-[(2z,5z,7z,9s,10s,11z)-10-methoxy-3,7,9,11-tetramethyltrideca-2,5,7,11-tetraenyl]-5-methyl-4-pyridinone
  • 1-hydroxy-2,3-dimethoxy-6-[(2z,5z,7z,9s,10s,11z)-10-methoxy-3,7,9,11-tetramethyltrideca-2,5,7,11-tetraenyl]-5-methylpyridin-4-one
  • 4-pyridinol, 2,3-dimethoxy-6-(10-methoxy-3,7,9,11-tetramethyl-2,5,7,11-tridecatetraenyl)-5-methyl-, 1-oxide, (s-(r*,r*-(all-e)))-
  • piericidin b(sub 1) n-oxide
  • piericidin b1 n-oxide
CAS Number(s)
  • 139182-76-6
InChIKey UGGPSLQRTUOXFD-PUTCWZFGSA-N
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