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DaturaMetelin I

DaturaMetelin I structure

DaturaMetelin I 

structure
  • CAS No:

    904667-65-8

  • Formula:

    C34H48O10

  • Chemical Name:

    DaturaMetelin I

  • Synonyms:

    DaturaMetelin I

  • Categories:

    Natural Products  >  Steroids

DaturaMetelin I Basic Attributes

616.7

616.324768

Characteristics

162.98000

1.56

1.4±0.1 g/cm3

828.8±65.0 °C at 760 mmHg

261.6±27.8 °C

1.615

Computed Properties

Molecular Weight:616.7
XLogP3:2.3
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:6
Exact Mass:616.32474772
Monoisotopic Mass:616.32474772
Topological Polar Surface Area:163
Heavy Atom Count:44
Complexity:1260
Defined Atom Stereocenter Count:14
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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