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Substance Name: Substance P, phe(5)-trp(7,9)-leu(11)-
RN: 96736-12-8
InChIKey: XVOCEQLNJQGCQG-UNAVROQCSA-N

Note

  • Substance P antagonist; bombesin antagonist.

Molecular Formula

  • C79-H109-N19-O12

Molecular Weight

  • 1516.85
 
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Names and Synonyms

Name of Substance

  • Substance P, phe(5)-trp(7,9)-leu(11)-

Synonyms

  • (Arg(1),phe(5),trp(7,9),leu(11))-substance P
  • 1-D-Arginine-5-D-phenylalanine-7-D-tryptophan-9-D-tryptophan-11-L-leucinamide- substance P
  • 5-Phe-7,9-trp-11-leu-substance P
  • 5-Phenylalanyl-7,9-tryptophyl-11-leucine-substance P
  • AntD
  • Apttl-SP
  • D-Arg(10)-D-phe(5)-D-trp(7,9)-leu(11)-SP
  • L-756,867
  • Substance P, arg(1)-phe(5)-trp(7,9)-leu(11)-
  • Substance P, arginyl(1)-phenylalanyl(5)-tryptophyl(7,9)-leucyl(11)-
  • Substance P, phenylalanyl(5)-tryptophyl(7,9)-leucine(11)-
  • Substance P-pttl

Systematic Name

  • Substance P, 1-D-arginine-5-D-phenylalanine-7-D-tryptophan-9-D-tryptophan-11-L-leucinamide-

Registry Numbers

CAS Registry Number

  • 96736-12-8

System Generated Number

  • 0096736128

Structure Descriptors

InChI

1S/C79H109N19O12/c1-46(2)38-59(68(83)100)91-70(102)60(39-47(3)4)92-73(105)64(43-51-45-88-56-28-14-12-25-53(51)56)95-72(104)61(40-48-20-7-5-8-21-48)93-74(106)63(42-50-44-87-55-27-13-11-24-52(50)55)94-69(101)57(32-33-67(82)99)89-71(103)62(41-49-22-9-6-10-23-49)96-76(108)66-31-19-37-98(66)78(110)58(29-15-16-34-80)90-75(107)65-30-18-36-97(65)77(109)54(81)26-17-35-86-79(84)85/h5-14,20-25,27-28,44-47,54,57-66,87-88H,15-19,26,29-43,80-81H2,1-4H3,(H2,82,99)(H2,83,100)(H,89,103)(H,90,107)(H,91,102)(H,92,105)(H,93,106)(H,94,101)(H,95,104)(H,96,108)(H4,84,85,86)/t54-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-/m0/s1

InChIKey

XVOCEQLNJQGCQG-UNAVROQCSA-N

Smiles

N(CCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(N1[C@H](C(N[C@H](C(N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(=O)N)CC(C)C)=O)CC(C)C)=O)Cc2c[nH]c3c2cccc3)=O)Cc2ccccc2)Cc2c[nH]c3c2cccc3)CCC(=O)N)=O)Cc2ccccc2)=O)CCC1)=O)CCCCN)C(N)=N