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Home> Encyclopedia > Hot Product Listed 5   > 5,12-Naphthacenedione,8-ethyl-7,8,9,10-tetrahydro-1,6,8,11-tetrahydroxy-7,10-bis[[2,3,6-trideoxy-4-O...
71161-92-7 structure

5,12-Naphthacenedione,8-ethyl-7,8,9,10-tetrahydro-1,6,8,11-tetrahydroxy-7,10-bis[[2,3,6-trideoxy-4-O-[2,6-dideoxy-4-O-[(2R,6S)-tetrahydro-6-methyl-5-oxo-2H-pyran-2-yl]-a-L-lyxo-hexopyranosyl]-3-(dimethylamino)-a-L-lyxo-hexopyranosyl]oxy]-,(7R,8R,10S)- (9CI)

CAS No.:71161-92-7
Molecular Weight:194.18345
Molecular Formula:C20H32O3 (isomer)
Names and Identifiers
Synonyms

CytorhodinA, 4C,4F-dideoxy-3B,3E-dihydroxy-4C,4F-dioxo-, (3BS,3ES)- Ditrisarubicin E

Inchi
InChI=1S/C7H8O3S.Na/c1-6-2-4-7(5-3-6)11(8,9)10;/h2-5H,1H3,(H,8,9,10);/q;+1/p-1
Canonical Smiles
CC1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]
Properties
Density
1.16
Flash Point
197.6°C
Computational chemical data
  • Molecular Weight:194.18345g/mol
  • Molecular Formula:C20H32O3
  • Exact Mass:194.001359
  • Monoisotopic Mass:194.001359
  • Complexity:211
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:65.6
  • Heavy Atom Count:12
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:2
 
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