Seneciphylline

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Properties Simple | Detailed

Formula C18H23NO5
IUPAC Name seneciphylline
Molecular Mass 333.379 g·mol−1
Heat of Formation -749.3 ± 16.7 kJ·mol−1
Dipole Moment 1.60 ± 1.08 D
Volume 396.38 Å 3
Surface Area 297.21 Å 2
HOMO Energy -8.88 ± 0.55 eV
LUMO Energy 0.41 ± eV
Point Group Symmetry C1
Synonyms
  • (3z,6r,14ar,14br)-3-ethylidene-6-hydroxy-6-methyl-5-methylene-3,4,5,6,9,11,13,14,14a,14b-decahydro[1,6]dioxacyclododecino[2,3,4-gh]pyrrolizine-2,7-dione
  • 13,19-didehydro-12-hydroxysenecionan-11,16-dione
  • bpbio1_000526
  • jacodine
  • pyrrolizine-2,7-dione, 3-ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6-hydroxy-6-methyl-5-methylene(1,6)dioxacyclododecino[2,3,4-gh]-
  • senecionan-11,16-dione, 13,19-didehydro-12-hydroxy-
  • senecionan-11,16-dione, 13,19-didehydro-12-hydroxy- (9ci)
  • seneciphyllin
  • seniciphylline
  • trans-15-ethylidene-12beta-hydroxy-12alpha-methyl-13-methylenesenec-1-enine
CAS Number(s)
  • 480-81-9
InChIKey FCEVNJIUIMLVML-QPSVUOIXSA-N
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