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Substance Name: 23-O-benzyl-5-mycaminosyl-tylonolide
RN: 89109-82-0
InChIKey: XGULBQUJRQPLOG-OOOULUNWSA-N

Molecular Formula

  • C38-H37-N-O10

Molecular Weight

  • 687.8653
 
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Names and Synonyms

Name of Substance

  • 23-O-Benzyl-5-mycaminosyl-tylonolide

Synonyms

  • 23-O-Benzyl-5-mycaminosyl-tylonolide
  • Tmc-101

Systematic Name

  • Tylonolide, 5-O-(3,6-dideoxy-3-(dimethylamino)-beta-D-glucopyranosyl)-23-O-(phenylmethyl)-

Registry Numbers

CAS Registry Number

  • 89109-82-0

System Generated Number

  • 0089109820

Structure Descriptors

InChI

1S/C38H57NO10/c1-8-32-29(22-46-21-27-12-10-9-11-13-27)18-23(2)14-15-30(41)24(3)19-28(16-17-40)37(25(4)31(42)20-33(43)48-32)49-38-36(45)34(39(6)7)35(44)26(5)47-38/h9-15,17-18,24-26,28-29,31-32,34-38,42,44-45H,8,16,19-22H2,1-7H3/b15-14+,23-18+/t24-,25+,26-,28+,29-,31-,32-,34+,35-,36-,37-,38+/m1/s1

InChIKey

XGULBQUJRQPLOG-OOOULUNWSA-N

Smiles

CC[C@H]1OC(=O)C[C@@H](O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)[C@@H](O)[C@@H]([C@H]2O)N(C)C)[C@@H](CC=O)C[C@@H](C)C(=O)\C=C\C(=C\[C@@H]1COCc3ccccc3)\C