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Substance Name: Substance P (4-11), beta-ala(4)-sar(9)-met(02)(11)-
RN: 110863-38-2
InChIKey: YLILVLOYQAQADF-MXTXSHIASA-N

Molecular Formula

  • C24-H67-N11-O12-S

Molecular Weight

  • 986.1553
 
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Names and Synonyms

Name of Substance

  • Substance P (4-11), beta-ala(4)-sar(9)-met(02)(11)-

Synonyms

  • 4-beta-Ala-9-sar-11-met(02)-substance P (4-11)
  • Ala-sar-met-SP(4-11)
  • Substance P (4-11), beta-alanyl(4)-sarcosyl(9)-methionine(02)(11)-

Systematic Name

  • Butanamide, beta-alanyl-L-glutaminyl-L-glutaminyl-L-phenylalanyl-L-phenylalanyl-N-methylglycyl-L-leucyl-4-(methylsulfonyl)-L-2-amino-

Registry Numbers

CAS Registry Number

  • 110863-38-2

System Generated Number

  • 0110863382

Structure Descriptors

InChI

1S/C45H67N11O12S/c1-26(2)21-32(40(61)35(69(4,67)68)24-29(47)41(50)62)52-39(60)25-56(3)45(66)34(23-28-13-9-6-10-14-28)55-44(65)33(22-27-11-7-5-8-12-27)54-43(64)31(16-18-37(49)58)53-42(63)30(15-17-36(48)57)51-38(59)19-20-46/h5-14,26,29-35H,15-25,46-47H2,1-4H3,(H2,48,57)(H2,49,58)(H2,50,62)(H,51,59)(H,52,60)(H,53,63)(H,54,64)(H,55,65)/t29?,30-,31-,32-,33-,34-,35?/m0/s1

InChIKey

YLILVLOYQAQADF-MXTXSHIASA-N

Smiles

CC(C)C[C@@H](C(=O)C(CC(C(=O)N)N)S(=O)(=O)C)NC(=O)CN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCC(=O)N)NC(=O)CCN