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Cembrane

Cembrane structure

Cembrane 

structure
  • CAS No:

    1786-12-5

  • Formula:

    C20H40

  • Chemical Name:

    Cembrane

  • Synonyms:

    Cyclotetradecane,1,7,11-trimethyl-4-(1-methylethyl)-;Cyclotetradecane,4-isopropyl-1,7,11-trimethyl-;1,7,11-Trimethyl-4-(1-methylethyl)cyclotetradecane;Cembrane;Octahydrocembrene;Octahydrothunbergene

Description

ChEBI: A 14-membered macrocyclic diterpene carrying an isopropyl group at C-1 and three symmetrically disposed methyl groups at C-4, -8 and -12.


Cembrane is a 14-membered macrocyclic diterpene carrying an isopropyl group at C-1 and three symmetrically disposed methyl groups at C-4, -8 and -12.

Cembrane Basic Attributes

280.54

280.53

DTXSID20873056

Characteristics

0

9.4

0.778±0.06 g/cm3(Predicted)

136-138 °C @ Press: 0.35 Torr

162.8ºC

1.427

6.55E-05mmHg at 25°C

Drug Information

cembrane

Computed Properties

Molecular Weight:280.5
XLogP3:9.4
Rotatable Bond Count:1
Exact Mass:280.313001276
Monoisotopic Mass:280.313001276
Heavy Atom Count:20
Complexity:210
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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