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Substance Name: Neurokinin B (4-10), beta-asp(4)-Me-phe(7)-
RN: 114317-52-1
InChIKey: FBZNCWPOYDVAMN-DUGSHLAESA-N

Molecular Formula

  • C45-H60-N8-O9-S

Molecular Weight

  • 889.082
 
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Names and Synonyms

Name of Substance

  • Neurokinin B (4-10), beta-asp(4)-Me-phe(7)-

Synonyms

  • 4-beta-Asp-7-Me-phe-neurokinin B (4-10)
  • Neurokinin B (4-10), beta-aspartyl(4)-methylphenylalanine(7)-
  • Nkb (4-10), beta-asp(4)-Me-phe(7)-

Systematic Name

  • L-Methioninamide, L-beta-aspartyl-L-phenylalanyl-L-phenylalanyl-N-methyl-L-phenylalanylglycyl-L-leucyl-

Registry Numbers

CAS Registry Number

  • 114317-52-1

System Generated Number

  • 0114317521

Structure Descriptors

InChI

1S/C45H60N8O9S/c1-28(2)22-36(50-38(54)27-49-41(57)35(48-3)24-30-16-10-6-11-17-30)42(58)51-34(20-21-63-4)43(59)53(39(55)26-33(47)45(61)62)44(60)37(25-31-18-12-7-13-19-31)52-40(56)32(46)23-29-14-8-5-9-15-29/h5-19,28,32-37,48H,20-27,46-47H2,1-4H3,(H,49,57)(H,50,54)(H,51,58)(H,52,56)(H,61,62)/t32-,33-,34-,35-,36-,37-/m0/s1

InChIKey

FBZNCWPOYDVAMN-DUGSHLAESA-N

Smiles

CC(C)C[C@@H](C(=O)N[C@@H](CCSC)C(=O)N(C(=O)C[C@@H](C(=O)O)N)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc2ccccc2)N)NC(=O)CNC(=O)[C@H](Cc3ccccc3)NC