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Substance Name: Bim 21009
RN: 106881-54-3
InChIKey: HVORXIZNATWEHI-UYAOYGJYSA-N

Note

  • Gonadorelin inhibitor.

Molecular Formula

  • C74-H92-Cl-N17-O13

Molecular Weight

  • 1463.1
 
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Names and Synonyms

Name of Substance

  • BIM 21009

Synonyms

  • 1-N-Ac-3(2-Naphthyl)ala-2-(4-Cl-phe)-3,7-phe-6,8-arg-10-alanh2-LHRH
  • Bim-21009
  • GNRH, N-Ac-3(2-naphthyl)ala(1)-(4-Cl-phe)(2)-phe(3,7)-arg(6,8)-alanh2(10)-
  • LHRH, N-Ac-3(2-Naphthyl)ala(1)-(4-Cl-phe)(2)-phe(3,7)-arg(6,8)-alanh2(10)-
  • LHRH, N-Acetyl-3(2-naphthyl)alanyl(1)-4-chlorophenylalanyl(2)-phenylalanyl(3,7)-arginyl(6,8)-alaninamide(10)-
  • LHRH-Ncpapa

Systematic Name

  • D-Alaninamide, N-acetyl-3-(2-naphthalenyl)-D-alanyl-4-chloro-D-phenylalanyl-D-phenylalanyl-L-seryl-L-tyrosyl-D-arginyl-L-phenylalanyl-L-arginyl-L-prolyl-

Registry Numbers

CAS Registry Number

  • 106881-54-3

System Generated Number

  • 0106881543

Structure Descriptors

InChI

1S/C74H92ClN17O13/c1-43(84-68(101)62-22-13-35-91(62)70(103)54(76)20-11-33-82-73(78)79)69(102)92(71(104)59(85-44(2)94)41-49-23-28-50-18-9-10-19-51(50)36-49)72(105)60(40-46-16-7-4-8-17-46)89-64(97)56(21-12-34-83-74(80)81)86-65(98)58(39-48-26-31-53(95)32-27-48)88-67(100)61(42-93)90-66(99)57(38-45-14-5-3-6-15-45)87-63(96)55(77)37-47-24-29-52(75)30-25-47/h3-10,14-19,23-32,36,43,54-62,93,95H,11-13,20-22,33-35,37-42,76-77H2,1-2H3,(H,84,101)(H,85,94)(H,86,98)(H,87,96)(H,88,100)(H,89,97)(H,90,99)(H4,78,79,82)(H4,80,81,83)/t43-,54+,55-,56-,57-,58+,59-,60+,61+,62+/m1/s1

InChIKey

HVORXIZNATWEHI-UYAOYGJYSA-N

Smiles

C([C@H](NC([C@H]1N(CCC1)C([C@@H](N)CCCNC(=N)N)=O)=O)C)(=O)N(C([C@@H](NC([C@H](NC([C@@H](NC([C@@H](NC([C@H](NC([C@H](N)Cc1ccc(cc1)Cl)=O)Cc1ccccc1)=O)CO)=O)Cc1ccc(O)cc1)=O)CCCNC(=N)N)=O)Cc1ccccc1)=O)C([C@H](NC(=O)C)Cc1cc2ccccc2cc1)=O