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Substance Name: Capreomycin ia sulfate
RN: 191719-40-1
UNII: 2V198449RN
InChIKey: JLRSDHJLZBDMJX-YKWRZAMXSA-N

Molecular Formula

  • C25-H44-N14-O8.2H2-O4-S

Molecular Weight

  • 864.8682
 
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Names and Synonyms

Name of Substance

  • Capreomycin ia sulfate

Synonyms

  • Capreomycin ia sulfate
  • Cyclo(3-(((3S)-3,6-diamino-1-oxohexyl)amino)-L-alanyl-(2Z)-3-((aminocarbonyl)amino)-2,3-didehydroalanyl-(2S)-2-((4R)-2-amino-1,4,5,6-tetrahydro-4-pyrimidinyl)glycyl-(2S)-2-amino-beta-alanyl-L-seryl), sulfate (salt)
  • UNII-2V198449RN

Registry Numbers

CAS Registry Number

  • 191719-40-1

FDA UNII

  • 2V198449RN

System Generated Number

  • 0191719401

Structure Descriptors

InChI

1S/C25H44N14O8.2H2O4S/c26-4-1-2-11(27)6-17(41)32-8-14-20(43)35-15(9-34-25(30)47)21(44)39-18(13-3-5-31-24(29)38-13)23(46)33-7-12(28)19(42)37-16(10-40)22(45)36-14;2*1-5(2,3)4/h9,11-14,16,18,40H,1-8,10,26-28H2,(H,32,41)(H,33,46)(H,35,43)(H,36,45)(H,37,42)(H,39,44)(H3,29,31,38)(H3,30,34,47);2*(H2,1,2,3,4)/b15-9-;;/t11-,12-,13+,14-,16-,18-;;/m0../s1

InChIKey

JLRSDHJLZBDMJX-YKWRZAMXSA-N

Smiles

C1CN=C(N[C@H]1[C@H]2C(=O)NC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N/C(=C\NC(=O)N)/C(=O)N2)CNC(=O)C[C@H](CCCN)N)CO)N)N.OS(=O)(=O)O.OS(=O)(=O)O