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Substance Name: SK&F 101071
RN: 81094-03-3
InChIKey: AUPQOJCSCYBFTO-YHKRPXQSSA-N

Note

  • Vasopressin antagonist.

Molecular Formula

  • C51-H73-N13-O10-S2

Molecular Weight

  • 1092.3507
 
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Names and Synonyms

Name of Substance

  • SK&F 101071

Synonyms

  • 1-(2-Mercapto-beta,beta-cyclopentamethylenepropionic acid)-2-phenylalanyl-4-valine-argipressin
  • Arginine vasopressin, (2-mercapto-beta,beta-cyclopentamethylenepropionic acid)(1)-phe(2)-val(4)-
  • Argipressin, (2-mercapto-beta,beta-cyclopentamethylenepropionic acid)(1)-phe(2)-val(4)-
  • d(CH2)5(D-Phe(2))vavp
  • SK&F-101071
  • Skf 101071

Systematic Name

  • Vasopressin, 1-(1-mercaptocyclohexaneacetic acid)-2-D-phenylalanine-4-L-valine-8-L-arginine-

Registry Numbers

CAS Registry Number

  • 81094-03-3

System Generated Number

  • 0081094033

Structure Descriptors

InChI

1S/C51H73N13O10S2/c1-30(2)42-48(73)61-36(26-39(52)65)45(70)62-37(49(74)64-23-13-19-38(64)47(72)59-33(18-12-22-56-50(54)55)43(68)57-28-40(53)66)29-75-76-51(20-10-5-11-21-51)27-41(67)58-34(24-31-14-6-3-7-15-31)44(69)60-35(46(71)63-42)25-32-16-8-4-9-17-32/h3-4,6-9,14-17,30,33-38,42H,5,10-13,18-29H2,1-2H3,(H2,52,65)(H2,53,66)(H,57,68)(H,58,67)(H,59,72)(H,60,69)(H,61,73)(H,62,70)(H,63,71)(H4,54,55,56)/t33-,34+,35-,36-,37-,38-,42-/m0/s1

InChIKey

AUPQOJCSCYBFTO-YHKRPXQSSA-N

Smiles

[H]/N=C(\N)/NCCC[C@@H](C(=O)NCC(=O)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]2CSSC3(CCCCC3)CC(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N2)CC(=O)N)C(C)C)Cc4ccccc4)Cc5ccccc5