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Substance Name: Muracein B
RN: 90965-61-0
InChIKey: QHRDRNITQKNXNS-JGYLIOAXSA-N

Note

  • From Norcardia orientalis.

Molecular Weight

  • 806.819
 
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Names and Synonyms

Name of Substance

  • Muracein B

Systematic Name

  • D-Alanine, N-(N-acetylmuramoyl)-L-alanyl-D-gamma-glutamyl-7-oxo-L-erythro-2,6,7-triaminoheptanoyl-D-alanyl-

Registry Numbers

CAS Registry Number

  • 90965-61-0

System Generated Number

  • 0090965610

Structure Descriptors

InChI

1S/C32H54N8O16/c1-11(37-26(46)14(4)55-24-22(39-15(5)42)32(54)56-20(10-41)23(24)44)28(48)40(13(3)30(50)51)29(49)12(2)38-27(47)17(33)7-6-16(21(35)25(36)45)19(43)9-8-18(34)31(52)53/h11-14,16-18,20-24,32,41,44,54H,6-10,33-35H2,1-5H3,(H2,36,45)(H,37,46)(H,38,47)(H,39,42)(H,50,51)(H,52,53)/t11-,12+,13+,14?,16?,17?,18-,20+,21?,22+,23+,24+,32-/m0/s1

InChIKey

QHRDRNITQKNXNS-JGYLIOAXSA-N

Smiles

C([C@H](N(C([C@H](NC([C@@H](CC[C@@H]([C@@H](C(=O)N)N)C(CC[C@H](N)C(=O)O)=O)N)=O)C)=O)C([C@@H](NC([C@@H](C)O[C@H]1[C@H](O)[C@@H](CO)O[C@@H](O)[C@@H]1NC(=O)C)=O)C)=O)C)(=O)O