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Substance Name: Vasopressin, 3-(3-beta-(2-thienyl)-ala)-8-lys-
RN: 67259-11-4
InChIKey: HFCCJWQSPPVHFF-DKTXOJPGSA-N

Molecular Formula

  • C44-H63-N13-O12-S3

Molecular Weight

  • 1062.2587
 
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Names and Synonyms

Name of Substance

  • Vasopressin, 3-(3-beta-(2-thienyl)-ala)-8-lys-

Synonyms

  • 3-(3-beta-(2-Thienyl)-ala)-8-lys-vasopressin
  • 3-(3-beta-(2-Thienyl)-alanyl)-8-lysine vasopressin
  • 3-(3-beta-(2-Thienyl)-L-alanine)-8-lysine-vasopressin
  • Vasopressin, 3-(3-beta-(2-thienyl)-alanyl)-8-lysine-

Systematic Name

  • Vasopressin, 3-(3-(2-thienyl)-beta-alanine)-8-L-lysine-

Registry Numbers

CAS Registry Number

  • 67259-11-4

System Generated Number

  • 0067259114

Structure Descriptors

InChI

1S/C44H63N13O12S3/c45-14-2-1-6-27(38(63)50-20-36(49)61)52-43(68)33-7-3-15-57(33)44(69)32-22-72-71-21-26(46)37(62)53-29(17-23-8-10-24(58)11-9-23)40(65)54-30(18-25-5-4-16-70-25)41(66)51-28(12-13-34(47)59)39(64)55-31(19-35(48)60)42(67)56-32/h4-5,8-11,16,26-33,58H,1-3,6-7,12-15,17-22,45-46H2,(H2,47,59)(H2,48,60)(H2,49,61)(H,50,63)(H,51,66)(H,52,68)(H,53,62)(H,54,65)(H,55,64)(H,56,67)/t26-,27-,28-,29-,30-,31-,32-,33-/m0/s1

InChIKey

HFCCJWQSPPVHFF-DKTXOJPGSA-N

Smiles

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]2CSSC[C@H](N)C(=O)N[C@@H](Cc3ccc(O)cc3)C(=O)N[C@@H](Cc4cccs4)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(=O)N)C(=O)N2)C(=O)NCC(=O)N