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Substance Name: Amoxicillin embonate
RN: 119229-00-4
UNII: 3V3X0IX41I
InChIKey: WXXKGMSZYRAJSK-XSULHWGKSA-N

Molecular Formula

  • C23-H16-O6.2C16-H19-N3-O5-S

Molecular Weight

  • 1119.1896
 
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Names and Synonyms

Results Name

  • Amoxicillin embonate

Name of Substance

  • Amoxicillin embonate

Synonyms

  • Amoxicillin embonate (2:1)
  • UNII-3V3X0IX41I

Systematic Name

  • 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-((amino(4-hydroxyphenyl)acetyl)amino)-3,3-dimethyl-7-oxo-, (2S-(2alpha,5alpha,6beta(S*)))-, 4,4'-methylenebis(3-hydroxy-2-naphthalenecarboxylate) (2:1) (salt)

Registry Numbers

CAS Registry Number

  • 119229-00-4

FDA UNII

  • 3V3X0IX41I

System Generated Number

  • 0119229004

Molecular Formulas

Molecular Formula

  • C23-H16-O6.2C16-H19-N3-O5-S

Molecular Formula Fragments

  • C16-H19-N3-O5-S
  • C23-H16-O6
  • COMPONENT

Structure Descriptors

InChI

1S/C23H16O6.2C16H19N3O5S/c24-20-16(14-7-3-1-5-12(14)9-18(20)22(26)27)11-17-15-8-4-2-6-13(15)10-19(21(17)25)23(28)29;2*1-16(2)11(15(23)24)19-13(22)10(14(19)25-16)18-12(21)9(17)7-3-5-8(20)6-4-7/h1-10,24-25H,11H2,(H,26,27)(H,28,29);2*3-6,9-11,14,20H,17H2,1-2H3,(H,18,21)(H,23,24)/t;2*9-,10-,11+,14-/m.11/s1

InChIKey

WXXKGMSZYRAJSK-XSULHWGKSA-N

Smiles

CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccc(O)cc3)C(=O)N2[C@H]1C(=O)O.CC4(C)S[C@@H]5[C@H](NC(=O)[C@H](N)c6ccc(O)cc6)C(=O)N5[C@H]4C(=O)O.OC(=O)c7cc8ccccc8c(Cc9c(O)c(cc%10ccccc9%10)C(=O)O)c7O