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Substance Name: Substance P (5-11), N-alpha-(desamino-3-iodotyrosyl)-8-N-me-phe-5,6-asp-
RN: 104499-96-9
InChIKey: VPONZIGMMCEIDS-JHROSDENSA-N

Molecular Weight

  • 1129.15
 
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Names and Synonyms

Name of Substance

  • Substance P (5-11), N-alpha-(desamino-3-iodotyrosyl)-8-N-me-phe-5,6-asp-

Synonyms

  • 125I BH-NH-Senktide
  • N-alpha-(Desamino-3-iodotyrosyl)-8-mephe-5,6-asp-substance P (5-11)
  • N-Methylphenylalanine(8)-substance P (5-11)
  • Substance P (5-11), N-alpha-(desamino-3-iodotyrosyl)-8-N-methylphenylalanine-5,6-asparagine-

Registry Numbers

CAS Registry Number

  • 104499-96-9

System Generated Number

  • 0104499969

Structure Descriptors

InChI

1S/C49H63IN8O13S/c1-28(2)21-35(54-41(61)27-52-44(66)34(51-3)23-29-11-7-5-8-12-29)46(68)55-33(19-20-72-4)45(67)58-49(71)36(24-30-13-9-6-10-14-30)56-48(70)38(26-43(64)65)57-47(69)37(25-42(62)63)53-40(60)18-16-31-15-17-39(59)32(50)22-31/h5-15,17,22,28,33-38,51,59H,16,18-21,23-27H2,1-4H3,(H,52,66)(H,53,60)(H,54,61)(H,55,68)(H,56,70)(H,57,69)(H,62,63)(H,64,65)(H,58,67,71)/t33-,34-,35-,36-,37-,38-/m0/s1/i50-2

InChIKey

VPONZIGMMCEIDS-JHROSDENSA-N

Smiles

C([C@@H](NC([C@@H](NC(CNC([C@@H](NC)Cc1ccccc1)=O)=O)CC(C)C)=O)CCSC)(=O)NC([C@@H](NC([C@@H](NC([C@@H](NC(CCc1cc(c(cc1)O)[125I])=O)CC(=O)O)=O)CC(=O)O)=O)Cc1ccccc1)=O