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Home > Encyclopedia > 6-O-(3'',4''-Dimethoxycinnamoyl)catalpol

6-O-(3'',4''-Dimethoxycinnamoyl)catalpol

6-O-(3'',4''-Dimethoxycinnamoyl)catalpol structure

6-O-(3'',4''-Dimethoxycinnamoyl)catalpol 

structure
  • CAS No:

    147714-71-4

  • Formula:

    C26H32O13

  • Chemical Name:

    6-O-(3'',4''-Dimethoxycinnamoyl)catalpol

  • Synonyms:

    6-O-(3'',4''-Dimethoxycinnamoyl)catalpol

  • Categories:

    Natural Products  >  Iridoid Derivatives

6-O-(3'',4''-Dimethoxycinnamoyl)catalpol Basic Attributes

552.5

552.184265

Characteristics

186.13000

-1.99

1.54±0.1 g/cm3(Predicted)

784.6±60.0 °C(Predicted)

261.8±26.4 °C

1.649

Computed Properties

Molecular Weight:552.5
XLogP3:-0.6
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:13
Rotatable Bond Count:10
Exact Mass:552.18429107
Monoisotopic Mass:552.18429107
Topological Polar Surface Area:186
Heavy Atom Count:39
Complexity:928
Defined Atom Stereocenter Count:11
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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