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Home > Encyclopedia > [(10R,13R,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 3-iodo-2,6-dimethylbenzoate

[(10R,13R,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 3-iodo-2,6-dimethylbenzoate

[(10R,13R,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 3-iodo-2,6-dimethylbenzoate structure

[(10R,13R,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 3-iodo-2,6-dimethylbenzoate 

structure
  • CAS No:

    124784-15-2

  • Formula:

    C36H53IO2

  • Chemical Name:

    [(10R,13R,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 3-iodo-2,6-dimethylbenzoate

  • Synonyms:

    2,6-DIBCE;2,6-dimethyl-3-iodobenzoate cholesterol ester;cholesteryl 2,6-dimethyl-3-iodobenzoate;124784-15-2;2,6-Dibce;Cholesteryl 2,6-dimethyl-3-iodobenzoate;2,6-Dimethyl-3-iodobenzoate cholesterol ester;DTXSID20924931;Cholest-5-en-3-yl 3-iodo-2,6-dimethylbenzoate;Cholest-5-en-3-ol (3beta)-, 3-iodo-2,6-dimethylbenzoate

[(10R,13R,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 3-iodo-2,6-dimethylbenzoate Basic Attributes

644.7 g/mol

644.30903 g/mol

Characteristics

26.3 Ų

Drug Information

2,6-DIBCE

Computed Properties

Molecular Weight:644.7
XLogP3:12.2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:8
Exact Mass:644.30903
Monoisotopic Mass:644.30903
Topological Polar Surface Area:26.3
Heavy Atom Count:39
Complexity:910
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of [(10R,13R,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 3-iodo-2,6-dimethylbenzoate

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