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Substance Name: Azithromycin monohydrate
RN: 121470-24-4
UNII: JTE4MNN1MD
InChIKey: HQUPLSLYZHKKQT-WVVFQGGUSA-N

Molecular Formula

  • C38-H72-N2-O12.H2-O

Molecular Weight

  • 767.0036
 
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Names and Synonyms

Results Name

  • Azithromycin monohydrate

Name of Substance

  • Azithromycin monohydrate

Synonyms

  • Azithromycin monohydrate
  • UNII-JTE4MNN1MD

Systematic Name

  • 1-Oxa-6-azacyclopentadecan-15-one, 13-((2,6-dideoxy-3-C-methyl-3-O-methyl-alpha-L-ribo-hexopyranosyl)oxy)-2-ethyl-3,4,10-trihydroxy-3,5,6,8,10,12,14-heptamethyl-11-((3,4,6-trideoxy-3- (dimethylamino)-beta-D-xylo-hexopyranosyl)oxy)-, monohydrate, (2R,3S,4R,5R,8R,10R,11R,12S,13S,14R)-

Registry Numbers

CAS Registry Number

  • 121470-24-4

FDA UNII

  • JTE4MNN1MD

System Generated Number

  • 0121470244

Molecular Formulas

Molecular Formula

  • C38-H72-N2-O12.H2-O

Molecular Formula Fragments

  • C38-H72-N2-O12
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C38H72N2O12.H2O/c1-15-27-38(10,46)31(42)24(6)40(13)19-20(2)17-36(8,45)33(52-35-29(41)26(39(11)12)16-21(3)48-35)22(4)30(23(5)34(44)50-27)51-28-18-37(9,47-14)32(43)25(7)49-28;/h20-33,35,41-43,45-46H,15-19H2,1-14H3;1H2/t20-,21-,22+,23-,24-,25+,26+,27-,28+,29-,30+,31-,32+,33-,35+,36-,37-,38-;/m1./s1

InChIKey

HQUPLSLYZHKKQT-WVVFQGGUSA-N

Smiles

CC[C@@H]1[C@@]([C@@H]([C@H](N(C[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)OC)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)O)C)C)C)O)(C)O.O