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Substance Name: Doxycycline 5-sulfosalicylate
RN: 60683-15-0
UNII: 5OMB5NO49J
InChIKey: JZNAMZVXOYKVJJ-CVHRZJFOSA-N

Molecular Formula

  • C22-H24-N2-O8.C7-H6-O6-S

Molecular Weight

  • 662.622
 
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Names and Synonyms

Name of Substance

  • Doxycycline 5-sulfosalicylate

Synonyms

  • EINECS 262-378-5
  • UNII-5OMB5NO49J

Systematic Name

  • 5-Sulphosalicylic acid, compound with 4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxonaphthacene-2-carboxamide (1:1)

Registry Numbers

CAS Registry Number

  • 60683-15-0

FDA UNII

  • 5OMB5NO49J

System Generated Number

  • 0060683150

Molecular Formulas

Molecular Formula

  • C22-H24-N2-O8.C7-H6-O6-S

Molecular Formula Fragments

  • C22-H24-N2-O8
  • C7-H6-O6-S
  • COMPONENT

Structure Descriptors

InChI

1S/C22H24N2O8.C7H6O6S/c1-7-8-5-4-6-9(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;8-6-2-1-4(14(11,12)13)3-5(6)7(9)10/h4-7,10,14-15,17,25,27-29,32H,1-3H3,(H2,23,31);1-3,8H,(H,9,10)(H,11,12,13)/t7-,10+,14+,15-,17-,22-;/m0./s1

InChIKey

JZNAMZVXOYKVJJ-CVHRZJFOSA-N

Smiles

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.OC(=O)c5cc(ccc5O)S(=O)(=O)O