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Substance Name: Cepafungin III
RN: 130743-09-8
InChIKey: ZQOSECHKDTUIEK-NUIZVSKESA-N

Note

  • From a Pseudomonas sp. strain.

Molecular Formula

  • C26-H42-N4-O6

Molecular Weight

  • 506.64
 
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Names and Synonyms

Name of Substance

  • Cepafungin III

Systematic Name

  • 2,4-Decadienamide, N-(2-hydroxy-1-(((10-hydroxy-5-methyl-2,7-dioxo-1,6-diazacyclododec-3-en-8-yl)amino)carbonyl)propyl)-9-methyl-, (SS-(3E,5R*,8R*(1R*(2E,4E),2S*),10R*))-

Registry Numbers

CAS Registry Number

  • 130743-09-8

System Generated Number

  • 0130743098

Structure Descriptors

InChI

1S/C26H42N4O6/c1-17(2)10-8-6-5-7-9-11-23(34)30-24(19(4)31)26(36)29-21-16-20(32)14-15-27-22(33)13-12-18(3)28-25(21)35/h5,7,9,11-13,17-21,24,31-32H,6,8,10,14-16H2,1-4H3,(H,27,33)(H,28,35)(H,29,36)(H,30,34)/b7-5+,11-9+,13-12-/t18-,19+,20-,21-,24-/m0/s1

InChIKey

ZQOSECHKDTUIEK-NUIZVSKESA-N

Smiles

C(\C=C\C=C\CCCC(C)C)(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H]1C(N[C@H](C=CC(NCC[C@@H](C1)O)=O)C)=O