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Home > Encyclopedia > (8R,9S,13S,14S,16R,17R)-13-methyl-2,4-dinitro-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,16,17-triol

(8R,9S,13S,14S,16R,17R)-13-methyl-2,4-dinitro-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,16,17-triol

(8R,9S,13S,14S,16R,17R)-13-methyl-2,4-dinitro-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,16,17-triol structure

(8R,9S,13S,14S,16R,17R)-13-methyl-2,4-dinitro-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,16,17-triol 

structure
  • CAS No:

    84605-03-8

  • Formula:

    C18H22N2O7

  • Chemical Name:

    (8R,9S,13S,14S,16R,17R)-13-methyl-2,4-dinitro-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,16,17-triol

  • Synonyms:

    2,4-dinitroestriol;84605-03-8;2,4-Dinitroestriol;DTXSID301004903;2,4-Dinitroestra-1(10),2,4-triene-3,16,17-triol;Estra-1,3,5(10)-triene-3,16,17-triol, 2,4-dinitro-, (16alpha,17beta)-

(8R,9S,13S,14S,16R,17R)-13-methyl-2,4-dinitro-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,16,17-triol Basic Attributes

378.4 g/mol

378.14270105 g/mol

Characteristics

152 Ų

Drug Information

2,4-dinitroestriol

Computed Properties

Molecular Weight:378.4
XLogP3:2.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Exact Mass:378.14270105
Monoisotopic Mass:378.14270105
Topological Polar Surface Area:152
Heavy Atom Count:27
Complexity:634
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of (8R,9S,13S,14S,16R,17R)-13-methyl-2,4-dinitro-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,16,17-triol

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