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Substance Name: Doxycycline hyclate [USAN:USP]
RN: 24390-14-5
UNII: 19XTS3T51U
InChIKey: HALQELOKLVRWRI-VDBOFHIQSA-N

Note

  • A synthetic tetracycline derivative with similar antimicrobial activity.

Classification Code

  • Antibacterial

Molecular Formula

  • C22-H24-N2-O8.Cl-H.1/2C2-H6-O.H2-O

Molecular Weight

  • 1025.8802
 
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Names and Synonyms

Name of Substance

  • Doxycycline hyclate
  • Doxycycline hyclate [USAN:USP]

Synonyms

  • 2-Naphthacenecarboxamide, 4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-, monohydrochloride, compd. with ethanol (2:1), monohydrate, (4S-(4alpha,4aalpha,5alpha,5aalpha,6alpha,12aalpha))-
  • 4-(Dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-2-naphthacenecarboxamide monohydrochloride, compound with ethyl alcohol (2:1), monohydrate
  • 6-Deoxy-5-hydroxytetracycline hydrochloride hemihydrate
  • Acticlate
  • Acticlate CAP
  • Atridox
  • Dentista
  • Doryx
  • Doryx Mpc
  • Doxteric
  • Doxy
  • Doxy 100
  • Doxy 200
  • Doxy-lemmon
  • Doxychel hyclate
  • Doxycycline hyclate
  • Doxycycline hydrochloride hemiethanolate hemihydrate
  • Doxyprex
  • Monodoks
  • NSC 741421
  • Periostat
  • Tetraclean
  • UNII-19XTS3T51U
  • Vibra-tabs
  • Vibramycin
  • Vivox
  • WC 2031

Systematic Names

  • 2-Naphthacenecarboxamide, 4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-, monohydrochloride, compd. with ethanol (2:1), monohydrate, (4S-(4alpha,4aalpha,5alpha,5aalpha,6alpha,12aalpha))-
  • 2-Naphthacenecarboxamide, 4beta-(dimeethylamino)-1,4,4abeta,5,5abeta,6,11,12a-octahydro-3,5beta,10,12,12abeta-pentahydroxy-6beta-methyl-1,11-dioxo-, monohydrochloride, compd. with ethyl alcohol (2:1), monohydrate
  • Ethanol, compd. with (4S,4aR,5S,5aR,6R,12aS)-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-2-naphthacenecarboxamide monohydrochloride (1:2), monohydrate

Superlist Name

  • Doxycycline hyclate (internal use)

Registry Numbers

CAS Registry Number

  • 24390-14-5

FDA UNII

  • 19XTS3T51U

Other Registry Number

  • 62149-53-5

System Generated Number

  • 0024390145

Molecular Formulas

Molecular Formula

  • C22-H24-N2-O8.Cl-H.1/2C2-H6-O.H2-O

Molecular Formula Fragments

  • C2-H6-O
  • C22-H24-N2-O8
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

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

Smiles

O.Cl.Cl.CCO.C[C@@H]1[C@H]2[C@H](O)[C@H]3[C@H](N(C)C)C(=C(C(=O)N)C(=O)[C@@]3(O)C(=C2C(=O)c4c(O)cccc14)O)O.C[C@@H]5[C@H]6[C@H](O)[C@H]7[C@H](N(C)C)C(=C(C(=O)N)C(=O)[C@@]7(O)C(=C6C(=O)c8c(O)cccc58)O)O