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Substance Name: Kibdelin D
RN: 105997-86-2
InChIKey: FZLZXWVVGYPKAS-BQYQJAHWSA-N

Note

  • From Kibdelosporangium aridum.

Molecular Weight

  • 1773.3778
 
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Names and Synonyms

Name of Substance

  • Kibdelin D

Systematic Name

  • Ristomycin A aglycone, 5,22,31,55-tetrachloro-7-demethyl-64-O-demethyl-56-O-(2-deoxy-2-((1-oxo-4-decenyl)amino)-beta-D-glucopyranosyl)-42-O-alpha-D-mannopyranosyl-N15-methyl-

Registry Numbers

CAS Registry Number

  • 105997-86-2

System Generated Number

  • 0105997862

Structure Descriptors

InChI

1S/C81H82Cl4N8O29/c1-3-4-5-6-7-8-9-10-53(100)87-63-68(105)66(103)51(28-94)120-80(63)122-72-49-22-33-23-50(72)118-71-41(83)19-34(20-42(71)84)65(102)62-78(113)91-60(79(114)115)38-24-35(96)25-48(119-81-70(107)69(106)67(104)52(29-95)121-81)54(38)37-17-30(11-14-43(37)97)57(74(109)93-62)88-75(110)58(33)89-76(111)59-39-26-36(27-45(99)55(39)85)116-47-21-31(12-15-44(47)98)56(86-2)73(108)92-61(77(112)90-59)64(101)32-13-16-46(117-49)40(82)18-32/h7-8,11-27,51-52,56-70,80-81,86,94-99,101-107H,3-6,9-10,28-29H2,1-2H3,(H,87,100)(H,88,110)(H,89,111)(H,90,112)(H,91,113)(H,92,108)(H,93,109)(H,114,115)/b8-7+

InChIKey

FZLZXWVVGYPKAS-BQYQJAHWSA-N

Smiles

CCCCC/C=C/CCC(=O)NC1C(C(C(OC1Oc2c3cc4cc2Oc5c(cc(cc5Cl)C(C6C(=O)NC(c7cc(cc(c7-c8cc(ccc8O)C(C(=O)N6)NC(=O)C4NC(=O)C9c1cc(cc(c1Cl)O)Oc1cc(ccc1O)C(C(=O)NC(C(c1ccc(c(c1)Cl)O3)O)C(=O)N9)NC)OC1C(C(C(C(O1)CO)O)O)O)O)C(=O)O)O)Cl)CO)O)O