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Substance Name: Chloropolysporin C
RN: 105650-12-2
InChIKey: ZRPIIHCQSYHVEJ-UHFFFAOYSA-N

Note

  • Isolated from Faenia interjecta sp. nov.

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C77-H79-Cl3-N8-O30

Molecular Weight

  • 1702.86
 
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Names and Synonyms

Name of Substance

  • Chloropolysporin C

Synonyms

  • Chloropolysporin C
  • Derhamnosylchloropolysporin B

Systematic Name

  • Avoparcin alpha, 10,49-dichloro-2(sup D)-O-de(3-amino-2,3,6-trideoxy-alpha-L-ribo-hexopyranosyl)-59-O-de(6-deoxy-alpha-L-mannopyranosyl)-

Registry Numbers

CAS Registry Number

  • 105650-12-2

System Generated Number

  • 0105650122

Structure Descriptors

InChI

1S/C77H79Cl3N8O30/c1-26-59(96)40(81)23-50(111-26)116-66-30-7-13-44(38(79)17-30)112-46-19-32-20-47(68(46)118-77-65(102)63(100)61(98)49(25-90)115-77)113-45-14-8-31(18-39(45)80)67(117-76-64(101)62(99)60(97)48(24-89)114-76)58(87-69(103)52(82-2)27-3-9-33(91)10-4-27)73(107)84-54(29-6-12-42(94)37(78)16-29)70(104)85-55(32)72(106)83-53-28-5-11-41(93)35(15-28)51-36(21-34(92)22-43(51)95)56(75(109)110)86-74(108)57(66)88-71(53)105/h3-22,26,40,48-50,52-67,76-77,82,89-102H,23-25,81H2,1-2H3,(H,83,106)(H,84,107)(H,85,104)(H,86,108)(H,87,103)(H,88,105)(H,109,110)

InChIKey

ZRPIIHCQSYHVEJ-UHFFFAOYSA-N

Smiles

O1[C@@H]([C@@H]([C@@H](C[C@@H]1O[C@@H]1[C@@H]2NC([C@@H](c3ccc(c(c3)c3c(cc(cc3[C@@H](NC2=O)C(O)=O)O)O)O)NC(=O)[C@@H]2NC([C@@H](NC([C@@H]([C@@H](c3ccc(Oc4cc2cc(c4O[C@@H]2O[C@@H]([C@@H]([C@@H]([C@@H]2O)O)O)CO)Oc2ccc1cc2Cl)c(c3)Cl)O[C@@H]1O[C@@H]([C@@H]([C@@H]([C@@H]1O)O)O)CO)NC([C@@H](c1ccc(cc1)O)NC)=O)=O)c1cc(c(cc1)O)Cl)=O)=O)N)O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 250mg/kg (250mg/kg)   Journal of Antibiotics. Vol. 40, Pg. 946, 1987.