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Substance Name: Vasotocin, desgly(NH2)(9)d(CH2)5-tyr(Me)(2)-thr(4)-orn(8)-
RN: 115499-13-3
InChIKey: GTCCRRPRDFVDJK-YMZDKENSSA-N

Note

  • Implicated in the control of seasonal changes in singing behavior of male canaries.

Molecular Formula

  • C45-H69-N9-O12-S2

Molecular Weight

  • 992.2231
 
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Names and Synonyms

Name of Substance

  • Vasotocin, desgly(NH2)(9)d(CH2)5-tyr(Me)(2)-thr(4)-orn(8)-

Synonyms

  • (1-(beta-Mercapto-beta,beta-cyclopentamethylenepropionic acid),2-O-methyltyrosine,4-threonine,8-ornithine)vasotocin
  • 2-O-Methyltyrosyl-4-threonyl-8-ornithyl-9-desglycinamide-vasotocin
  • Desgly(9)-d(CH2)5(tyr(Me)(2)-thr(4))ovt
  • Desgly(NH2)(9)d(CH2)5-(tyr(Me)(2),thr(4),orn(8))VT
  • Desgly-NH2(9),d(CH2)5(1)(tyr(Me)(2),thr(4))ovt
  • Desglycinamide(9)-1-(beta-mercapto-(beta,beta-cyclopentamethylene)propionic acid)-O-methyltyrosyl(2)-threonyl(4)-ornithyl(8)-vasotocin
  • dGVTA
  • OVT16
  • Vasotocin, 1-(beta-mercapto-(beta,beta-cyclopentamethylene)propionic acid)-O-methyltyrosyl(2)-threonyl(4)-ornithyl(8)-desglycinade(9)-
  • Vasotocin, desgly(NH2)(9)d(CH2)5-methyltyrosyl(2)-threonyl(4)-ornithyl(8)-

Systematic Name

  • L-Ornithine, N-((1-mercaptocyclohexyl)acetyl)-O-methyl-L-tyrosyl-L-isoleucyl-L-threonyl-L-asparaginyl-L-cysteinyl-L-prolyl-, cyclic (1-5)-disulfide

Registry Numbers

CAS Registry Number

  • 115499-13-3

System Generated Number

  • 0115499133

Structure Descriptors

InChI

1S/C45H69N9O12S2/c1-5-24(2)37(52-40(60)30(20-26-14-16-28(56)17-15-26)48-36(58)21-27-10-6-7-13-34(27)68)42(62)53-38(25(3)55)43(63)50-31(22-35(47)57)39(59)51-32(23-67)44(64)54-19-9-12-33(54)41(61)49-29(11-8-18-46)45(65)66-4/h14-17,24-25,27,29-33,37-38,55-56,67H,5-13,18-23,46H2,1-4H3,(H2,47,57)(H,48,58)(H,49,61)(H,50,63)(H,51,59)(H,52,60)(H,53,62)/t24-,25+,27?,29-,30-,31-,32-,33-,37-,38-/m0/s1

InChIKey

GTCCRRPRDFVDJK-YMZDKENSSA-N

Smiles

CC[C@H](C)[C@@H](C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CS)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCN)C(=O)OC)NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)CC3CCCCC3=S