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Substance Name: Somatostatin, azidonitrobenzoyl-lys(9)-iodo-tyr(11)-
RN: 130772-41-7
InChIKey: BCIXQLQPMIXMPL-YPSIBLKKSA-N

Note

  • Identifies somatostatin receptors.

Molecular Formula

  • C83-H106-N22-O23-S2

Molecular Weight

  • 1844.0134
 
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Names and Synonyms

Name of Substance

  • Somatostatin, azidonitrobenzoyl-lys(9)-iodo-tyr(11)-

Synonyms

  • 9-(N6-(5-Azido-2-nitrobenzyl)-L-lysine)-11-L-tyrosinesomatostatin (sheep)
  • 9-Lys-11-iodo-tyr-azidonitrobenzoyl-somatostatin
  • Anb-lys(9)-somatostatin
  • Somatostatin,azidonitrobenzoyl-lysine(9)-iodotyrosine(11)-

Systematic Name

  • Somatostatin (sheep), 9-(N6-(5-azido-2-nitrobenzyl)-L-lysine)-11-L-tyrosine-

Registry Numbers

CAS Registry Number

  • 130772-41-7

System Generated Number

  • 0130772417

Structure Descriptors

InChI

1S/C83H106N22O23S2/c1-43(85)70(112)90-39-67(111)91-63-41-129-130-42-64(83(125)126)100-79(121)62(40-106)99-82(124)69(45(3)108)102-78(120)59(34-48-24-27-51(109)28-25-48)98-81(123)68(44(2)107)101-73(115)56(23-13-15-31-88-71(113)53-36-50(103-104-87)26-29-65(53)105(127)128)92-76(118)60(35-49-38-89-54-21-11-10-20-52(49)54)96-75(117)58(33-47-18-8-5-9-19-47)94-74(116)57(32-46-16-6-4-7-17-46)95-77(119)61(37-66(86)110)97-72(114)55(93-80(63)122)22-12-14-30-84/h4-11,16-21,24-29,36,38,43-45,55-64,68-69,89,106-109H,12-15,22-23,30-35,37,39-42,84-85H2,1-3H3,(H2,86,110)(H,88,113)(H,90,112)(H,91,111)(H,92,118)(H,93,122)(H,94,116)(H,95,119)(H,96,117)(H,97,114)(H,98,123)(H,99,124)(H,100,121)(H,101,115)(H,102,120)(H,125,126)/t43-,44+,45+,55-,56-,57-,58-,59-,60-,61-,62-,63-,64-,68?,69?/m0/s1

InChIKey

BCIXQLQPMIXMPL-YPSIBLKKSA-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)N[C@H](C(=O)N1)CCCCNC(=O)c2cc(ccc2[N+](=O)[O-])N=[N+]=[N-])Cc3c[nH]c4c3cccc4)Cc5ccccc5)Cc6ccccc6)CC(=O)N)CCCCN)NC(=O)CNC(=O)[C@H](C)N)C(=O)O)CO)[C@@H](C)O)Cc7ccc(cc7)O)O