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Substance Name: Erythromycin, 4-O-alpha-D-glucopyranosyl-D-gluconate (salt)
RN: 69779-46-0
InChIKey: NNRXCKZMQLFUPL-HOODTPICSA-N

Molecular Formula

  • C37-H67-N-O13.C12-H22-O12

Molecular Weight

  • 1092.22
 
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Names and Synonyms

  • Erythromycin, 4-O-alpha-D-glucopyranosyl-D-gluconate (salt)

Registry Numbers

CAS Registry Number

  • 69779-46-0

System Generated Number

  • 0069779460

Structure Descriptors

InChI

1S/C37H67NO13.C12H22O12/c1-14-25-37(10,45)30(41)20(4)27(39)18(2)16-35(8,44)32(51-34-28(40)24(38(11)12)15-19(3)47-34)21(5)29(22(6)33(43)49-25)50-26-17-36(9,46-13)31(42)23(7)48-26;13-1-3(15)10(7(18)8(19)11(21)22)24-12-9(20)6(17)5(16)4(2-14)23-12/h18-26,28-32,34,40-42,44-45H,14-17H2,1-13H3;3-10,12-20H,1-2H2,(H,21,22)/t18-,19-,20+,21+,22-,23+,24+,25-,26+,28-,29+,30-,31?,32-,34+,35-,36-,37-;3-,4-,5-,6+,7-,8-,9-,10-,12-/m11/s1

InChIKey

NNRXCKZMQLFUPL-HOODTPICSA-N

Smiles

C([C@H](O)[C@@H](O)[C@H](O[C@@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)CO)[C@H](O)CO)(=O)O.O1[C@H]([C@@H]([C@H](C[C@H]1C)N(C)C)O)O[C@@H]1[C@H]([C@@H]([C@H](C(O[C@H](CC)[C@]([C@@H]([C@H](C([C@@H](C[C@]1(O)C)C)=O)C)O)(O)C)=O)C)O[C@H]1C[C@@](C)(OC)[C@@H]([C@@H](C)O1)O)C