(6R)-6-[(1E,3Z,5R,7E,9E,11R,13S,14R,15S)-3-Ethyl-14-Hydroxy-5,9,11,13,15-Pentamethyl-12-Oxo-1,3,7,9-Heptadecatetraen-1-Yl]-5,6-Dihydro-2H-Pyran-2-One

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Properties Simple | Detailed

Formula C29H44O4
IUPAC Name (2r)-2-[(1e,3z,5r,7e,9e,11r,13s,14r,15s)-3-ethyl-14-hydroxy-5,9,11,13,15-pentamethyl-12-oxo-heptadeca-1,3,7,9-tetraenyl]-3,5-dihydro-2h-pyran-5-id-6-one
Molecular Mass 456.657 g·mol−1
Heat of Formation -567.1 ± 16.7 kJ·mol−1
Dipole Moment 10.14 ± 1.08 D
Volume 624.05 Å 3
Surface Area 442.23 Å 2
Point Group Symmetry C1
Synonyms
  • (6r)-6-[(1e,3z,5r,7e,9e,11r,13s,14r,15s)-3-ethyl-14-hydroxy-12-keto-5,9,11,13,15-pentamethyl-heptadeca-1,3,7,9-tetraenyl]-5,6-dihydropyran-2-one
  • (6r)-6-[(1e,3z,5r,7e,9e,11r,13s,14r,15s)-3-ethyl-14-hydroxy-5,9,11,13,15-pentamethyl-12-oxo-heptadeca-1,3,7,9-tetraenyl]-5,6-dihydropyran-2-one
  • (6r)-6-[(1e,3z,5r,7e,9e,11r,13s,14r,15s)-3-ethyl-14-hydroxy-5,9,11,13,15-pentamethyl-12-oxoheptadeca-1,3,7,9-tetraenyl]-5,6-dihydropyran-2-one
  • 2h-pyran-2-one, 6-((1e,3z,5r,7e,9e,11r,13s,14r,15s)-3-ethyl-14-hydroxy-5,9,11,13,15-pentamethyl-12-oxo-1,3,7,9-heptadecatetraenyl)-5,6-dihydro-, (6r)-
  • 2h-pyran-2-one, 6-(3-ethyl-14-hydroxy-5,9,11,13,15-pentamethyl-12-oxo-1,3,7,9-heptadecatetraenyl)-5,6-dihydro-
  • 2h-pyran-2-one, 6-[(1e,3z,5r,7e,9e,11r,13s,14r,15s)-3-ethyl-14-hydroxy-5,9,11,13,15-pentamethyl-12-oxo-1,3,7,9-heptadecatetraenyl]-5,6-dihydro-, (6r)-
  • callystatin a
CAS Number(s)
  • 189883-16-7
InChIKey QPJTWGLLJWBDQW-KMMMXHTBSA-N
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