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Substance Name: Macrocin
RN: 11049-15-3
InChIKey: UFUYRGNJTFAODM-MIUQDMJTSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C45-H75-N-O17

Molecular Weight

  • 902.078
 
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Names and Synonyms

Name of Substance

  • Macrocin

Synonyms

  • 3(sup C)-O-Demethyltylosin
  • BRN 6468979
  • Tylosin C

Systematic Names

  • Macrocin
  • Tylosin, 3(sup C)-O-demethyl- (9CI)

Registry Numbers

CAS Registry Number

  • 11049-15-3

System Generated Number

  • 0011049153

Structure Descriptors

InChI

1S/C45H75NO17/c1-12-32-29(21-57-44-41(56-11)38(53)36(51)25(5)59-44)17-22(2)13-14-30(48)23(3)18-28(15-16-47)39(24(4)31(49)19-33(50)61-32)63-43-37(52)35(46(9)10)40(26(6)60-43)62-34-20-45(8,55)42(54)27(7)58-34/h13-14,16-17,23-29,31-32,34-44,49,51-55H,12,15,18-21H2,1-11H3/b14-13+,22-17+/t23-,24+,25-,26-,27+,28+,29?,31-,32-,34+,35-,36-,37-,38-,39?,40-,41-,42+,43+,44-,45-/m1/s1

InChIKey

UFUYRGNJTFAODM-MIUQDMJTSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 800mg/kg (800mg/kg)   Journal of Antibiotics, Series A. Vol. 17, Pg. 133, 1964.