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Agatharesinol acetonide

Agatharesinol acetonide structure

Agatharesinol acetonide 

structure
  • CAS No:

    800389-33-7

  • Formula:

    C20H22O4

  • Chemical Name:

    Agatharesinol acetonide

  • Synonyms:

    Agatharesinol acetonide;4-[(1E,3S)-3-[(4S)-2,2-Dimethyl-1,3-dioxolan-4-yl]-3-(4-hydroxyphenyl)-1-propen-1-yl]phenol

  • Categories:

    Natural Products  >  Lignans

Description

Agatharesinol acetonide is a member of phenols. It has a role as a metabolite.

Agatharesinol acetonide Basic Attributes

326.38628

326.151794

Characteristics

58.9

3.18

1.2±0.1 g/cm3

484.8±40.0 °C at 760 mmHg

247.0±27.3 °C

1.618

Computed Properties

Molecular Weight:326.4
XLogP3:3.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:326.15180918
Monoisotopic Mass:326.15180918
Topological Polar Surface Area:58.9
Heavy Atom Count:24
Complexity:417
Defined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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