4-{(5S)-5-[(2R,3Z,5R,6S,7S,8E,12E)-6-Hydroxy-7-Methoxy-3,5-Dimethyl-14-Oxooxacyclotetradeca-3,8,12-Trien-2-Yl]-4-Oxohexyl}-2,6-Piperidinedione

Molecule SVG Image

Properties Simple | Detailed

Formula C27H39NO7
IUPAC Name 4-[(5s)-5-[(2r,3z,5r,6s,7s,8e,12e)-6-hydroxy-7-methoxy-3,5-dimethyl-14-oxo-1-oxacyclotetradeca-3,8,12-trien-2-yl]-4-oxohexyl]piperidine-2,6-dione
Molecular Mass 489.601 g·mol−1
Heat of Formation -1350.4 ± 16.7 kJ·mol−1
Dipole Moment 5.06 ± 1.08 D
Volume 621.91 Å 3
Surface Area 434.96 Å 2
HOMO Energy -9.54 ± 0.55 eV
LUMO Energy -0.20 ± eV
Point Group Symmetry C1
Synonyms
  • 4-[(5s)-5-[(2r,3z,5r,6s,7s,8e,12e)-6-hydroxy-14-keto-7-methoxy-3,5-dimethyl-1-oxacyclotetradeca-3,8,12-trien-2-yl]-4-keto-hexyl]piperidine-2,6-quinone
  • 4-[(5s)-5-[(2r,3z,5r,6s,7s,8e,12e)-6-hydroxy-7-methoxy-3,5-dimethyl-14-oxo-1-oxacyclotetradeca-3,8,12-trien-2-yl]-4-oxo-hexyl]piperidine-2,6-dione
InChIKey OGYMUMAKGYYNHV-IJMHZYIBSA-N
QR Code Generate QR Code
Links PubChem Wikipedia ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N