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Substance Name: A 76154
RN: 136989-30-5
InChIKey: OVJXZVMFCYBEPE-RWRBTDCVSA-N

Note

  • Gonadorelin antagonist.

Molecular Weight

  • 1313.57
 
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Names and Synonyms

Name of Substance

  • A 76154

Synonyms

  • (N-((4-Fluorophenyl)propionyl)-1Nal(3),nmetyr(5),lys(nic)(6),lys(isp)(8),ala(10)NH2)(3-10)LHRH
  • A-76154

Registry Numbers

CAS Registry Number

  • 136989-30-5

System Generated Number

  • 0136989305

Structure Descriptors

InChI

1S/C70H93FN12O12/c1-43(2)38-58(79-63(88)54(72)21-9-12-36-77-62(87)50-19-14-34-75-41-50)68(93)83(67(92)57(74-6)39-47-26-31-52(85)32-27-47)65(90)45(5)82(70(95)60-23-15-37-81(60)66(91)55(73)22-10-11-35-76-44(3)4)69(94)59(42-84)80-64(89)56(40-49-18-13-17-48-16-7-8-20-53(48)49)78-61(86)33-28-46-24-29-51(71)30-25-46/h7-8,13-14,16-20,24-27,29-32,34,41,43-45,54-60,74,76,84-85H,9-12,15,21-23,28,33,35-40,42,72-73H2,1-6H3,(H,77,87)(H,78,86)(H,79,88)(H,80,89)/t45-,54-,55+,56-,57+,58+,59+,60+/m1/s1

InChIKey

OVJXZVMFCYBEPE-RWRBTDCVSA-N

Smiles

C([C@H](N(C([C@H]1N(CCC1)C([C@@H](N)CCCCNC(C)C)=O)=O)C([C@@H](NC([C@H](NC(CCc1ccc(cc1)F)=O)Cc1cccc2ccccc12)=O)CO)=O)C)(=O)N(C([C@@H](NC([C@H](N)CCCCNC(=O)c1cnccc1)=O)CC(C)C)=O)C([C@@H](NC)Cc1ccc(O)cc1)=O