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Substance Name: Somatostatin, des-asn(5)-
RN: 54786-81-1
InChIKey: ZIHRAPFYJSDXSV-ROWAAPPRSA-N

Molecular Formula

  • C72-H98-N16-O17-S2

Molecular Weight

  • 1523.7932
 
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Names and Synonyms

Name of Substance

  • Somatostatin, des-asn(5)-

Synonyms

  • 5-Deasparagine-somatostatin
  • 5-Des-asn-somatostatin
  • 5-Des-asn-srih
  • Somatostatin, deasparagine(5)-

Systematic Name

  • Growth hormone-release inhibiting factor (sheep), 5-de-L-aspargine-

Registry Numbers

CAS Registry Number

  • 54786-81-1

System Generated Number

  • 0054786811

Structure Descriptors

InChI

1S/C72H98N16O17S2/c1-40(75)61(93)77-36-58(92)78-56-38-106-107-39-57(72(104)105)86-68(100)55(37-89)85-71(103)60(42(3)91)88-67(99)53(33-45-23-11-6-12-24-45)84-70(102)59(41(2)90)87-63(95)50(28-16-18-30-74)79-66(98)54(34-46-35-76-48-26-14-13-25-47(46)48)83-65(97)52(32-44-21-9-5-10-22-44)82-64(96)51(31-43-19-7-4-8-20-43)81-62(94)49(80-69(56)101)27-15-17-29-73/h4-14,19-26,35,40-42,49-57,59-60,76,89-91H,15-18,27-34,36-39,73-75H2,1-3H3,(H,77,93)(H,78,92)(H,79,98)(H,80,101)(H,81,94)(H,82,96)(H,83,97)(H,84,102)(H,85,103)(H,86,100)(H,87,95)(H,88,99)(H,104,105)/t40-,41+,42+,49-,50-,51-,52-,53-,54-,55-,56-,57-,59?,60?/m0/s1

InChIKey

ZIHRAPFYJSDXSV-ROWAAPPRSA-N

Smiles

C[C@H](C1C(=O)N[C@H](C(=O)NC(C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CCCCN)Cc2c[nH]c3c2cccc3)Cc4ccccc4)Cc5ccccc5)CCCCN)NC(=O)CNC(=O)[C@H](C)N)C(=O)O)CO)[C@@H](C)O)Cc6ccccc6)O