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Substance Name: N-Acetylsplenopeptin
RN: 120834-20-0
InChIKey: YNSIBIFVJKPWMX-CPHHOOCTSA-N

Molecular Formula

  • C33-H53-N9-O10

Molecular Weight

  • 735.835
 
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Names and Synonyms

  • N-Acetylsplenopeptin

Registry Numbers

CAS Registry Number

  • 120834-20-0

System Generated Number

  • 0120834200

Structure Descriptors

InChI

1S/C33H53N9O10/c1-18(2)27(31(50)41-25(32(51)52)17-20-9-11-21(44)12-10-20)42-30(49)24(13-14-26(45)46)40-29(48)23(7-4-5-15-34)39-28(47)22(38-19(3)43)8-6-16-37-33(35)36/h9-12,18,22-25,27,44H,4-8,13-17,34H2,1-3H3,(H,38,43)(H,39,47)(H,40,48)(H,41,50)(H,42,49)(H,45,46)(H,51,52)(H4,35,36,37)/t22-,23-,24-,25-,27-/m0/s1

InChIKey

YNSIBIFVJKPWMX-CPHHOOCTSA-N

Smiles

C([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC(=O)C)CCCNC(=N)N)=O)CCCCN)=O)CCC(=O)O)=O)C(C)C)=O)Cc1ccc(O)cc1)(=O)O