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Content language

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Concept information

... > ماده شیمیایی > هستار مولکولی > موجود چند اتمی > موجودیت مولکولی هترواتمی > ترکیب افزودنی > آبپوش‌شدن > doxycycline hyclate

Preferred term

doxycycline hyclate  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C46H58Cl2N4O18

has_part

has_role

inchi

  • InChI=1S/2C22H24N2O8.C2H6O.2ClH.H2O/c2*1-7-8-5-4-6-9(25)11(8)16(26)12-10(7)17(27)14-15(24(2)3)18(28)13(21(23)31)20(30)22(14,32)19(12)29;1-2-3;;;/h2*4-7,10,14-15,17,25,27-29,32H,1-3H3,(H2,23,31);3H,2H2,1H3;2*1H;1H2/t2*7-,10+,14+,15-,17-,22-;;;;/m00..../s1

inchikey

  • HALQELOKLVRWRI-VDBOFHIQSA-N

mass

  • 1025.87500

monoisotopicmass

  • 1024.31232

smiles

  • O.[Cl-].[Cl-].CCO.[H][C@@]12[C@@H](C)c3cccc(O)c3C(=O)C1=C(O)[C@]1(O)C(=O)C(C(N)=O)=C(O)[C@@H]([NH+](C)C)[C@]1([H])[C@H]2O.[H][C@@]12[C@@H](C)c3cccc(O)c3C(=O)C1=C(O)[C@]1(O)C(=O)C(C(N)=O)=C(O)[C@@H]([NH+](C)C)[C@]1([H])[C@H]2O

subset

  • 3_STAR

synonym RELATED

  • (1S,4aS,11R,11aR,12S,12aR)-3-carbamoyl-2,4a,5,7,12-pentahydroxy-N,N,11-trimethyl-4,6-dioxo-1,4,4a,6,11,11a,12,12a-octahydrotetracen-1-aminium chloride--ethanol--water (2/1/1)
  • 6-deoxy-5-hydroxytetracycline hydrochloride hemihydrate
  • doxycycline hydrochloride hemiethanolate hemihydrate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:34730

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