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Substance Name: Vasopressin, 1-(beta-mercapto-beta,beta-cyclopentamethylene propionic acid)-(O-ethyl)tyr(2)-val(4)-lys(8)-N(6)-carboxytetramethylrhodamine-
RN: 139468-40-9
InChIKey: SYKQAUMNGCITMM-XFWDJTBKSA-N

Molecular Weight

  • 1520.83
 
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Names and Synonyms

Name of Substance

  • Vasopressin, 1-(beta-mercapto-beta,beta-cyclopentamethylene propionic acid)-(O-ethyl)tyr(2)-val(4)-lys(8)-N(6)-carboxytetramethylrhodamine-

Synonyms

  • (beta-Mercapto-beta,beta-cyclopentamethylemepropionic acid)-2-(O-ethyl)tyr-4-val-8-lys-N(6)carboxytetramethylrhodamine vasopressin
  • R-Clvp
  • Vasopressin,1-(beta-mercapto-beta,beta-cyclopentamethylene propionic acid)-(O-ethyl)tyrosyl(2)-valyl(4)-lysine(8)-N(6)-carboxytetramethylrhodamine-

Registry Numbers

CAS Registry Number

  • 139468-40-9

System Generated Number

  • 0139468409

Structure Descriptors

InChI

1S/C78H97N13O15S2/c1-8-105-51-27-22-47(23-28-51)37-57(83-65(93)42-78(108)32-14-10-15-33-78)71(97)84-58(36-46-18-11-9-12-19-46)73(99)88-68(45(2)3)75(101)85-59(41-64(80)92)72(98)86-60(44-107)76(102)91-35-17-21-61(91)74(100)87-66(94)43-82-70(96)56(79)20-13-16-34-81-69(95)48-24-29-52(77(103)104)55(38-48)67-53-30-25-49(89(4)5)39-62(53)106-63-40-50(90(6)7)26-31-54(63)67/h9-12,14,18-19,22-31,38-40,45,56-61,68H,8,13,15-17,20-21,32-37,41-44,79H2,1-7H3,(H12-,80,81,82,83,84,85,86,87,88,92,93,94,95,96,97,98,99,100,101,103,104,107,108)/t56-,57+,58-,59-,60-,61-,68-,78?/m0/s1

InChIKey

SYKQAUMNGCITMM-XFWDJTBKSA-N

Smiles

C(CNC([C@@H](N)CCCCNC(c1cc(c(cc1)C(=O)[O-])c1c2ccc(cc2[o+]c2cc(ccc12)N(C)C)N(C)C)=O)=O)(=O)NC([C@H]1N(CCC1)C([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@H](NC(=O)C[C@@]1(CCC=CC1)S)Cc1ccc(OCC)cc1)=O)Cc1ccccc1)=O)C(C)C)=O)CC(=O)N)=O)CS)=O)=O