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Home > Encyclopedia > [(3S,6aR,6aR,6bR,8aR,11R,12aR,14aR,14bR)-4,4,6a,6b,8a,11,14b-heptamethyl-12-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,11,12a,13,14,14a-hexadecahydropicen-3-yl] acetate

[(3S,6aR,6aR,6bR,8aR,11R,12aR,14aR,14bR)-4,4,6a,6b,8a,11,14b-heptamethyl-12-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,11,12a,13,14,14a-hexadecahydropicen-3-yl] acetate

[(3S,6aR,6aR,6bR,8aR,11R,12aR,14aR,14bR)-4,4,6a,6b,8a,11,14b-heptamethyl-12-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,11,12a,13,14,14a-hexadecahydropicen-3-yl] acetate structure

[(3S,6aR,6aR,6bR,8aR,11R,12aR,14aR,14bR)-4,4,6a,6b,8a,11,14b-heptamethyl-12-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,11,12a,13,14,14a-hexadecahydropicen-3-yl] acetate 

structure
  • CAS No:

    138349-56-1

  • Formula:

    C32H52O2

  • Chemical Name:

    [(3S,6aR,6aR,6bR,8aR,11R,12aR,14aR,14bR)-4,4,6a,6b,8a,11,14b-heptamethyl-12-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,11,12a,13,14,14a-hexadecahydropicen-3-yl] acetate

  • Synonyms:

    Calotropenyl acetate; Urs-19(29)-en-3-ol,acetate,(3beta); (3|A,5xi,18|A)-urs-19(29)-en-3-yl acetate; 2-(diethylamino)acetylamino-3-methyl-1-phenylindole;

[(3S,6aR,6aR,6bR,8aR,11R,12aR,14aR,14bR)-4,4,6a,6b,8a,11,14b-heptamethyl-12-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,11,12a,13,14,14a-hexadecahydropicen-3-yl] acetate Basic Attributes

468.75400

335.199762429 g/mol

Characteristics

26.30000

8.59560

1.09g/cm3

444.4ºC

222.5ºC

1.587

4.3E-08mmHg at 25°C

Computed Properties

Molecular Weight:335.4
XLogP3:4.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:335.199762429
Monoisotopic Mass:335.199762429
Topological Polar Surface Area:37.3
Heavy Atom Count:25
Complexity:431
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of [(3S,6aR,6aR,6bR,8aR,11R,12aR,14aR,14bR)-4,4,6a,6b,8a,11,14b-heptamethyl-12-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,11,12a,13,14,14a-hexadecahydropicen-3-yl] acetate

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