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Substance Name: Erythromyclamine
RN: 13368-00-8
InChIKey: XCLJRCAJSCMIND-FRSXEBCHSA-N

Molecular Formula

  • C37-H70-N2-O12

Molecular Weight

  • 734.962
 
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Names and Synonyms

Name of Substance

  • Erythromyclamine

Synonyms

  • 9(S)-Erythromycylamine
  • 9-Amino-9-deoxoerythromycin

Systematic Name

  • Erythromycin, 9-amino-9-deoxo-

Registry Numbers

CAS Registry Number

  • 13368-00-8

System Generated Number

  • 0013368008

Structure Descriptors

InChI

1S/C37H70N2O12/c1-14-25-37(10,45)30(41)20(4)27(38)18(2)16-35(8,44)32(51-34-28(40)24(39(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/h18-32,34,40-42,44-45H,14-17,38H2,1-13H3/t18-,19-,20+,21+,22-,23+,24+,25-,26+,27?,28-,29+,30-,31+,32-,34+,35-,36-,37-/m1/s1

InChIKey

XCLJRCAJSCMIND-FRSXEBCHSA-N

Smiles

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