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Home > Encyclopedia > 2,5,14-Triacetoxy-3-benzoyloxy-8,15-dihydroxy-7-isobutyroyloxy-9-nicotinoyloxyjatropha-6(17),11E-diene

2,5,14-Triacetoxy-3-benzoyloxy-8,15-dihydroxy-7-isobutyroyloxy-9-nicotinoyloxyjatropha-6(17),11E-diene

2,5,14-Triacetoxy-3-benzoyloxy-8,15-dihydroxy-7-isobutyroyloxy-9-nicotinoyloxyjatropha-6(17),11E-diene structure

2,5,14-Triacetoxy-3-benzoyloxy-8,15-dihydroxy-7-isobutyroyloxy-9-nicotinoyloxyjatropha-6(17),11E-diene 

structure
  • CAS No:

    210108-87-5

  • Formula:

    C43H53NO14

  • Chemical Name:

    2,5,14-Triacetoxy-3-benzoyloxy-8,15-dihydroxy-7-isobutyroyloxy-9-nicotinoyloxyjatropha-6(17),11E-diene

  • Synonyms:

    2,5,14-Triacetoxy-3-benzoyloxy-8,15-dihydroxy-7-isobutyroyloxy-9-nicotinoyloxyjatropha-6(17),11E-diene;Jatrophane 3

  • Categories:

    Natural Products  >  Terpenes

2,5,14-Triacetoxy-3-benzoyloxy-8,15-dihydroxy-7-isobutyroyloxy-9-nicotinoyloxyjatropha-6(17),11E-diene Basic Attributes

807.9

807.346619

Characteristics

211.15000

6.34

1.3±0.1 g/cm3

809.9±65.0 °C at 760 mmHg

443.6±34.3 °C

1.572

Computed Properties

Molecular Weight:807.9
XLogP3:4.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:15
Rotatable Bond Count:15
Exact Mass:807.34660536
Monoisotopic Mass:807.34660536
Topological Polar Surface Area:211
Heavy Atom Count:58
Complexity:1580
Defined Atom Stereocenter Count:10
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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