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Substance Name: 6-Valine-tyrocidine A
RN: 79774-98-4
InChIKey: MIYFLTAAHTZJNH-BEYAGSDRSA-N

Note

  • Has the same antibiotic activity as tyrocidine A.

Molecular Weight

  • 1258.91
 
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Names and Synonyms

Name of Substance

  • 6-Valine-tyrocidine A

Synonyms

  • (L-Val(6))-TA
  • 6-L-Valine-tyrocidine A
  • Gramicidin S, 5-D-phenylalanine-6-L-asparagine-7-L-glutamine-8-L-tyrosine-, monohydrochloride
  • Val-TA

Systematic Name

  • Tyrocidine A, 9-L-valine-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 79774-98-4

System Generated Number

  • 0079774984

Structure Descriptors

InChI

1S/C62H87N13O13.ClH/c1-35(2)29-46(57(83)72-48(32-39-17-11-8-12-18-39)62(88)75-28-14-20-49(75)59(85)74-52(36(3)4)60(86)67-41(34-76)30-38-15-9-7-10-16-38)70-55(81)44(19-13-27-63)69-61(87)53(37(5)6)73-58(84)47(31-40-21-23-42(77)24-22-40)71-56(82)45(25-26-50(65)78)68-54(80)43(64)33-51(66)79;/h7-12,14-18,21-24,28,34-37,41,43-49,52-53,77H,13,19-20,25-27,29-33,63-64H2,1-6H3,(H2,65,78)(H2,66,79)(H,67,86)(H,68,80)(H,69,87)(H,70,81)(H,71,82)(H,72,83)(H,73,84)(H,74,85);1H/t41-,43+,44+,45+,46+,47+,48-,49+,52+,53+;/m1./s1

InChIKey

MIYFLTAAHTZJNH-BEYAGSDRSA-N

Smiles

C([C@H](NC([C@@H](NC([C@H]1N(C=CC1)C([C@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](N)CC(=O)N)=O)CCC(=O)N)=O)Cc1ccc(O)cc1)=O)C(C)C)=O)CCCN)=O)CC(C)C)=O)Cc1ccccc1)=O)=O)C(C)C)=O)Cc1ccccc1)=O.Cl