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Home> Encyclopedia > Hot Product Listed 5   > 5,12-Naphthacenedione,8-ethyl-7,8,9,10-tetrahydro-1,6,7,8-tetrahydroxy-10-[[2,3,6-trideoxy-3-(dimeth...
82-42-8 structure

5,12-Naphthacenedione,8-ethyl-7,8,9,10-tetrahydro-1,6,7,8-tetrahydroxy-10-[[2,3,6-trideoxy-3-(dimethylamino)-a-L-lyxo-hexopyranosyl]oxy]-,[7R-(7a,8b,10b)]- (9CI)

Iupac Name:1-chloro-4-hydroxyanthracene-9,10-dione
CAS No.:82-42-8
Molecular Weight:258.65658
Molecular Formula:C15H15NO (isomer)
Names and Identifiers
Synonyms

AntibioticY 262-3 Yellamycin A

Inchi
InChI=1/C14H7ClO3/c15-9-5-6-10(16)12-11(9)13(17)7-3-1-2-4-8(7)14(12)18/h1-6,16H
Canonical Smiles
C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)Cl)O
Properties
Density
1.76
Refractive Index
1.699
Computational chemical data
  • Molecular Weight:258.65658g/mol
  • Molecular Formula:C15H15NO
  • XLogP3-AA:4.2
  • Exact Mass:258.008372
  • Monoisotopic Mass:258.008372
  • Complexity:381
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:54.4
  • Heavy Atom Count:18
  • 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:1
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