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Substance Name: L 366811
RN: 127819-95-8
InChIKey: PQTORSHXODXZHK-FZOIMTHESA-N

Note

  • A potent oxytocin antagonist.

Molecular Formula

  • C43-H56-N8-O6

Molecular Weight

  • 780.9654
 
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Names and Synonyms

Name of Substance

  • L 366811

Synonyms

  • Cyclo-(proline-tryptophan-isoleucine-pipecolic acid-piperazine-2-carboxylic acid-N-Me-phenylalanine)
  • L-366,811
  • L-366811

Systematic Name

  • Cyclo(L-isoleucyl-D-2-piperidinecarbonyl-L-2-piperazinecarbonyl-N-methyl-D-phenylalanyl-L-prolyl-D-tryptophyl)

Registry Numbers

CAS Registry Number

  • 127819-95-8

System Generated Number

  • 0127819958

Structure Descriptors

InChI

1S/C43H56N8O6/c1-4-29(2)37(44)40(55)51(32(28-52)25-30-27-47-34-15-7-6-14-33(30)34)39(54)36-16-12-22-50(36)38(53)35(45-3)26-31-13-8-9-17-43(31,41(56)48-20-10-5-11-21-48)42(57)49-23-18-46-19-24-49/h5-11,13-15,20,27-29,32,35-37,45-47H,4,12,16-19,21-26,44H2,1-3H3/t29-,32+,35+,36-,37-,43-/m0/s1

InChIKey

PQTORSHXODXZHK-FZOIMTHESA-N

Smiles

CC[C@H](C)[C@@H](C(=O)N([C@H](Cc1c[nH]c2c1cccc2)C=O)C(=O)[C@@H]3CCCN3C(=O)[C@@H](CC4=CC=CC[C@@]4(C(=O)N5CCNCC5)C(=O)N6CC=CC=C6)NC)N