Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Ardacin B
RN: 95935-22-1
UNII: X66V65NS5Z
InChIKey: RRLODODSHAQKPU-HBAKJDICSA-N

Molecular Formula

  • C82-H84-Cl4-N8-O30

Molecular Weight

  • 1803.4036
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Ardacin B

Synonyms

  • AAD-216B
  • Antibiotic AAD-216B
  • Ardacin B
  • Aridicin B
  • Ristomycin A aglycone, 5,22,31,55-tetrachloro-7-demethyl-64-O-demethyl-56-O-(2-deoxy-2-((9-methyl-1-oxodecyl)amino)-beta-D-glucopyranuronosyl)-42-o-alpha-D-mannopyranosyl-N15-methyl-
  • UNII-X66V65NS5Z

Registry Numbers

CAS Registry Number

  • 95935-22-1

FDA UNII

  • X66V65NS5Z

System Generated Number

  • 0095935221

Structure Descriptors

InChI

1S/C82H84Cl4N8O30/c1-29(2)9-7-5-4-6-8-10-52(100)88-62-66(104)68(106)72(80(116)117)124-81(62)123-71-49-22-33-23-50(71)120-70-41(84)19-34(20-42(70)85)64(102)61-78(113)92-59(79(114)115)38-24-35(96)25-48(121-82-69(107)67(105)65(103)51(28-95)122-82)53(38)37-17-30(11-14-43(37)97)56(74(109)94-61)89-75(110)57(33)90-76(111)58-39-26-36(27-45(99)54(39)86)118-47-21-31(12-15-44(47)98)55(87-3)73(108)93-60(77(112)91-58)63(101)32-13-16-46(119-49)40(83)18-32/h11-27,29,51,55-69,72,81-82,87,95-99,101-107H,4-10,28H2,1-3H3,(H,88,100)(H,89,110)(H,90,111)(H,91,112)(H,92,113)(H,93,108)(H,94,109)(H,114,115)(H,116,117)/t51-,55-,56-,57-,58+,59+,60-,61+,62-,63-,64-,65-,66-,67+,68+,69+,72+,81-,82+/m1/s1

InChIKey

RRLODODSHAQKPU-HBAKJDICSA-N

Smiles

CC(C)CCCCCCCC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1Oc2c3cc4cc2Oc5c(cc(cc5Cl)[C@H]([C@H]6C(=O)N[C@@H](c7cc(cc(c7-c8cc(ccc8O)[C@H](C(=O)N6)NC(=O)[C@@H]4NC(=O)[C@@H]9c1cc(cc(c1Cl)O)Oc1cc(ccc1O)[C@H](C(=O)N[C@H]([C@@H](c1ccc(c(c1)Cl)O3)O)C(=O)N9)NC)O[C@@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)C(=O)O)O)Cl)C(=O)O)O)O