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Substance Name: Ristomycin A aglycone, 7-demethyl-64-O-demethyl-19-deoxy-11-O-galactosyl-22,31,35-trichloro-
RN: 89140-21-6
InChIKey: ZADJTTUAVDYGPY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C64-H54-Cl3-N7-O23

Molecular Weight

  • 1395.5156
 
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Names and Synonyms

Synonyms

  • 7-Demethyl-64-O-demethyl-19-deoxy-11-O-galactosyl-22,31,35-trichlororistomycin A aglycone
  • A41030C
  • Antibiotic A 41030C

Systematic Name

  • Ristomycin A aglycone, 7-demethyl-64-O-demethyl-19-deoxy-11-O-galactosyl-22,31,35-trichloro-

Registry Numbers

CAS Registry Number

  • 89140-21-6

System Generated Number

  • 0089140216

Structure Descriptors

InChI

1S/C64H54Cl3N7O23/c65-32-7-21-1-4-37(32)94-41-15-26-16-42(53(41)81)95-38-5-3-23(12-33(38)66)51(79)50-62(90)73-49(63(91)92)30-18-28(77)19-36(78)44(30)31-11-25(13-34(67)52(31)80)47(61(89)74-50)71-60(88)48(26)72-59(87)46-24-9-27(76)17-29(10-24)93-40-14-22(45(68)58(86)69-35(8-21)57(85)70-46)2-6-39(40)96-64-56(84)55(83)54(82)43(20-75)97-64/h1-7,9-19,35,43,45-51,54-56,64,75-84H,8,20,68H2,(H,69,86)(H,70,85)(H,71,88)(H,72,87)(H,73,90)(H,74,89)(H,91,92)

InChIKey

ZADJTTUAVDYGPY-UHFFFAOYSA-N

Smiles

c1cc2c(cc1CC3C(=O)NC(c4cc(cc(c4)Oc5cc(ccc5OC6C(C(C(C(O6)CO)O)O)O)C(C(=O)N3)N)O)C(=O)NC7c8cc(c(c(c8)Oc9ccc(cc9Cl)C(C1C(=O)NC(c3cc(cc(c3-c3cc(cc(c3O)Cl)C(C(=O)N1)NC7=O)O)O)C(=O)O)O)O)O2)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 300mg/kg (300mg/kg)   European Patent Application. Vol. #90578,