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Substance Name: Somatostatin, ala(2)-trp(8)-cys(14)-
RN: 66610-28-4
InChIKey: GZIHAMRRMVNZON-CPXPFECHSA-N

Molecular Formula

  • C77-H106-N18-O19-S2

Molecular Weight

  • 1651.9234
 
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Names and Synonyms

Name of Substance

  • Somatostatin, ala(2)-trp(8)-cys(14)-

Synonyms

  • 2-Ala-8-trp-14-cys-somatostatin
  • 2-Alanyl-8-tryptophyl-14-cysteine-somatostatin
  • Somatostatin, alanyl(2)-tryptophyl(8)-cysteine(14)-

Systematic Name

  • Somatostatin (sheep), 2-L-alanine-8-D-tryptophan-14-D-cysteine-

Registry Numbers

CAS Registry Number

  • 66610-28-4

System Generated Number

  • 0066610284

Structure Descriptors

InChI

1S/C77H106N18O19S2/c1-41(80)64(100)83-42(2)65(101)92-59-39-115-116-40-60(77(113)114)93-73(109)58(38-96)91-76(112)63(44(4)98)95-72(108)55(34-47-24-12-7-13-25-47)90-75(111)62(43(3)97)94-67(103)52(29-17-19-31-79)84-70(106)56(35-48-37-82-50-27-15-14-26-49(48)50)88-69(105)54(33-46-22-10-6-11-23-46)86-68(104)53(32-45-20-8-5-9-21-45)87-71(107)57(36-61(81)99)89-66(102)51(85-74(59)110)28-16-18-30-78/h5-15,20-27,37,41-44,51-60,62-63,82,96-98H,16-19,28-36,38-40,78-80H2,1-4H3,(H2,81,99)(H,83,100)(H,84,106)(H,85,110)(H,86,104)(H,87,107)(H,88,105)(H,89,102)(H,90,111)(H,91,112)(H,92,101)(H,93,109)(H,94,103)(H,95,108)(H,113,114)/t41-,42-,43+,44+,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,62-,63-/m0/s1

InChIKey

GZIHAMRRMVNZON-CPXPFECHSA-N

Smiles

C[C@@H](O)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)[C@H](Cc5ccccc5)NC(=O)[C@H](Cc6ccccc6)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@H](CO)NC1=O)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](C)N)[C@@H](C)O