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Substance Name: 9-Deoxo-9-((2-methoxyethyl)amino)-erythromycin, (9S)-
RN: 112452-23-0
InChIKey: KWYPBTFVCXEUKG-HBKDEBGTSA-N

Molecular Formula

  • C40-H76-N2-O13

Molecular Weight

  • 793.0414
 
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Names and Synonyms

Synonym

  • 9-N-(2-Methoxyethyl)erythromycylamine

Systematic Name

  • 9-Deoxo-9-((2-methoxyethyl)amino)-erythromycin, (9S)-

Registry Numbers

CAS Registry Number

  • 112452-23-0

System Generated Number

  • 0112452230

Structure Descriptors

InChI

1S/C40H76N2O13/c1-15-28-40(10,48)33(44)23(4)30(41-16-17-49-13)21(2)19-38(8,47)35(55-37-31(43)27(42(11)12)18-22(3)51-37)24(5)32(25(6)36(46)53-28)54-29-20-39(9,50-14)34(45)26(7)52-29/h21-35,37,41,43-45,47-48H,15-20H2,1-14H3/t21-,22-,23+,24+,25-,26+,27+,28-,29+,30?,31-,32+,33-,34+,35-,37+,38-,39-,40-/m1/s1

InChIKey

KWYPBTFVCXEUKG-HBKDEBGTSA-N

Smiles

CC[C@@H]1[C@@]([C@@H]([C@H](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)NCCOC)C)O)(C)O