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Ajugamarin B 1

Ajugamarin B 1 structure

Ajugamarin B 1 

structure
  • CAS No:

    121449-65-8

  • Formula:

    C31H44O11

  • Chemical Name:

    Ajugamarin B 1

  • Synonyms:

    dihydroajugamarin; Ajugamarin B 1;

Ajugamarin B 1 Basic Attributes

592.67400

592.28836222 g/mol

Characteristics

144.03000

3.45560

1.23g/cm3

662ºC

273.3ºC

1.531

2.64E-17mmHg at 25°C

Computed Properties

Molecular Weight:592.7
XLogP3:3
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:14
Exact Mass:592.28836222
Monoisotopic Mass:592.28836222
Topological Polar Surface Area:144
Heavy Atom Count:42
Complexity:1150
Defined Atom Stereocenter Count:8
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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