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Substance Name: MM 55268
RN: 137053-19-1
InChIKey: WYCHNRSSNSYYGA-UHFFFAOYSA-N

Note

  • Produced by Amycolatopsis.

Molecular Formula

  • C87-H91-Cl5-N8-O35

Molecular Weight

  • 1985.9619
 
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Names and Synonyms

Name of Substance

  • MM 55268

Synonym

  • MM-55268

Systematic Names

  • Ristomycin A aglycone, 5,22,31,45,55-pentachloro-7-demethyl-64-O-demethyl-34-O-((2-deoxy-2-((1-oxodecyl)amino)-alpha-D-glucopyranuronosyl)amino)-44-O-beta-D-glucopyranosyl-56-O-beta-D-mannopyranosyl-N15-methyl-
  • Ristomycin A aglycone, 5,22,31,45,55-pentachloro-7-demethyl-64-O-demethyl-34-O-((2-deoxy-2-((1-oxydecyl)amino)-alpha-D-glucopyranuronosyl)amino)-44-O-beta-D-glucopyranosyl-56-O-beta-D-mannopyranosyl-N15-methyl-

Registry Numbers

CAS Registry Number

  • 137053-19-1

System Generated Number

  • 0137053191

Structure Descriptors

InChI

1S/C87H91Cl5N8O35/c1-3-4-5-6-7-8-9-10-52(107)94-81-68(113)66(111)54(82(122)123)86(134-81)131-71-33-18-42(90)73(43(91)19-33)129-50-22-32-21-49(74(50)133-85-39(27-101)64(109)69(114)84(126)135-85)128-47-14-12-30(16-40(47)88)63(108)61-79(120)97-59(38-25-35(26-46(106)55(38)92)127-48-20-29(11-13-44(48)104)56(93-2)75(116)99-61)78(119)96-58(32)76(117)95-57-31-15-37(72(41(89)17-31)132-87-70(115)67(112)65(110)51(28-102)130-87)53-36(23-34(103)24-45(53)105)60(83(124)125)98-80(121)62(71)100-77(57)118/h11-26,39,51,54,56-71,81,84-87,93,101-106,108-115,126H,3-10,27-28H2,1-2H3,(H,94,107)(H,95,117)(H,96,119)(H,97,120)(H,98,121)(H,99,116)(H,100,118)(H,122,123)(H,124,125)

InChIKey

WYCHNRSSNSYYGA-UHFFFAOYSA-N

Smiles

CCCCCCCCCC(=O)NC1C(C(C(C(O1)OC2c3cc(c(c(c3)Cl)Oc4cc5cc(c4OC6C(C(C(C(O6)O)O)O)CO)Oc7ccc(cc7Cl)C(C8C(=O)NC(c9cc(cc(c9Cl)O)Oc1cc(ccc1O)C(C(=O)N8)NC)C(=O)NC5C(=O)NC1c3cc(c(c(c3)Cl)OC3C(C(C(C(O3)CO)O)O)O)-c3c(cc(cc3O)O)C(NC(=O)C2NC1=O)C(=O)O)O)Cl)C(=O)O)O)O