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Substance Name: Vasopressin, 1-deamino-leu(4)-lys(8)-
RN: 42061-33-6
InChIKey: QGZMLGLFLYCDQT-PEAOEFARSA-N

Molecular Formula

  • C47-H67-N11-O11-S2

Molecular Weight

  • 1026.2443
 
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Names and Synonyms

Name of Substance

  • Vasopressin, 1-deamino-leu(4)-lys(8)-

Synonyms

  • 1-Deamino-4-leu-8-lys-vasopressin
  • Vasopressin, 1-deamino-leucyl(4)-lysine(8)-

Systematic Name

  • Vasopressin, 1-(3-mercaptopropanoic acid)-4-L-leucine-8-L-lysine-

Registry Numbers

CAS Registry Number

  • 42061-33-6

System Generated Number

  • 0042061336

Structure Descriptors

InChI

1S/C47H67N11O11S2/c1-27(2)21-32-42(64)56-35(24-38(49)60)45(67)57-36(47(69)58-19-8-12-37(58)46(68)53-31(11-6-7-18-48)41(63)51-25-39(50)61)26-71-70-20-17-40(62)52-33(23-29-13-15-30(59)16-14-29)43(65)55-34(44(66)54-32)22-28-9-4-3-5-10-28/h3-5,9-10,13-16,27,31-37,59H,6-8,11-12,17-26,48H2,1-2H3,(H2,49,60)(H2,50,61)(H,51,63)(H,52,62)(H,53,68)(H,54,66)(H,55,65)(H,56,64)(H,57,67)/t31-,32-,33-,34-,35-,36-,37-/m0/s1

InChIKey

QGZMLGLFLYCDQT-PEAOEFARSA-N

Smiles

CC(C)C[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(=O)N)NC1=O)C(=O)N4CCC[C@H]4C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N