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Substance Name: Substance P (4-11), pro(4)-trp(7,9,10)-
RN: 86917-57-9
InChIKey: SFUBGXWEUDKBIR-XWYQIVALSA-N

Note

  • Tachykinin antagonist.

Molecular Formula

  • C62-H74-N14-O10-S

Molecular Weight

  • 1207.42
 
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Names and Synonyms

Name of Substance

  • Substance P (4-11), pro(4)-trp(7,9,10)-

Synonyms

  • 4-Pro-7,9,10-trp-substance P (4-11)
  • 4-Prolyl-7,9,10-tryptophan-substance P (4-11)
  • Gpant-1
  • Pttt-SP(4-11)
  • Substance P (4-11), prolyl(4)-tryptophan(7,9,10)-

Systematic Name

  • L-Methioninamide, L-prolyl-L-glutaminyl-L-glutaminyl-L-tryptophyl-L-phenylalanyl-L-tryptophyl-L-tryptophyl-

Registry Numbers

CAS Registry Number

  • 86917-57-9

Other Registry Number

  • 83334-92-3

System Generated Number

  • 0086917579

Structure Descriptors

InChI

1S/C62H74N14O10S/c1-87-27-25-45(55(65)79)70-60(84)50(29-36-32-67-42-17-8-5-14-39(36)42)76-62(86)52(31-38-34-69-44-19-10-7-16-41(38)44)75-59(83)49(28-35-12-3-2-4-13-35)73-61(85)51(30-37-33-68-43-18-9-6-15-40(37)43)74-58(82)48(22-24-54(64)78)72-57(81)47(21-23-53(63)77)71-56(80)46-20-11-26-66-46/h2-10,12-19,32-34,45-52,66-69H,11,20-31H2,1H3,(H2,63,77)(H2,64,78)(H2,65,79)(H,70,84)(H,71,80)(H,72,81)(H,73,85)(H,74,82)(H,75,83)(H,76,86)/t45-,46+,47-,48-,49-,50+,51+,52+/m0/s1

InChIKey

SFUBGXWEUDKBIR-XWYQIVALSA-N

Smiles

C([C@@H](NC([C@H](NC([C@H](NC([C@@H](NC([C@H](NC([C@@H](NC([C@@H](NC([C@@H]1NCCC1)=O)CCC(=O)N)=O)CCC(=O)N)=O)Cc1c[nH]c2ccccc12)=O)Cc1ccccc1)=O)Cc1c[nH]c2ccccc12)=O)Cc1c[nH]c2ccccc12)=O)CCSC)(=O)N