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Substance Name: Oxytocin, lys(8)-
RN: 4273-93-2
InChIKey: KYAVDXJYBQPLOR-OMTOYRQASA-N

Molecular Formula

  • C43-H67-N13-O12-S2

Molecular Weight

  • 1022.21
 
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Names and Synonyms

Name of Substance

  • Oxytocin, lys(8)-

Synonyms

  • 8-Lys-oxytocin
  • OXL
  • Oxytocin, lysine(8)-

Systematic Name

  • Oxytocin, 8-L-lysine-

Registry Numbers

CAS Registry Number

  • 4273-93-2

System Generated Number

  • 0004273932

Structure Descriptors

InChI

1S/C43H67N13O12S2/c1-3-22(2)35-42(67)51-27(13-14-32(46)58)38(63)53-29(18-33(47)59)39(64)54-30(21-70-69-20-25(45)36(61)52-28(40(65)55-35)17-23-9-11-24(57)12-10-23)43(68)56-16-6-8-31(56)41(66)50-26(7-4-5-15-44)37(62)49-19-34(48)60/h9-12,22,25-31,35,57H,3-8,13-21,44-45H2,1-2H3,(H2,46,58)(H2,47,59)(H2,48,60)(H,49,62)(H,50,66)(H,51,67)(H,52,61)(H,53,63)(H,54,64)(H,55,65)/t22-,25-,26-,27-,28-,29-,30-,31-,35?/m0/s1

InChIKey

KYAVDXJYBQPLOR-OMTOYRQASA-N

Smiles

C1CC[C@H](C(=O)N[C@H](C(NCC(N)=O)=O)CCCCN)N1C([C@@H]1CSSC[C@H](N)C(N[C@H](C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1)Cc1ccc(O)cc1)=O)=O