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Substance Name: Vasopressin, 9-homo-lys-
RN: 34289-07-1
InChIKey: NMQZTNQHZOPBHR-VTGDPKQBSA-N

Molecular Formula

  • C47-H67-N13-O12-S2

Molecular Weight

  • 1070.2573
 
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Names and Synonyms

Name of Substance

  • Vasopressin, 9-homo-lys-

Synonyms

  • 9-Homo-lys-vasopressin
  • 9-Homolysine vasopressin
  • 9-L-Homolysine-vasopressin
  • Vasopressin, 9-homolysine-

Systematic Name

  • Vasopressin, 8-(L-2,7-diaminoheptanoic acid)-

Registry Numbers

CAS Registry Number

  • 34289-07-1

System Generated Number

  • 0034289071

Structure Descriptors

InChI

1S/C47H67N13O12S2/c48-18-6-2-5-10-30(41(66)53-23-39(52)64)55-46(71)36-11-7-19-60(36)47(72)35-25-74-73-24-29(49)40(65)56-32(21-27-12-14-28(61)15-13-27)44(69)57-33(20-26-8-3-1-4-9-26)43(68)54-31(16-17-37(50)62)42(67)58-34(22-38(51)63)45(70)59-35/h1,3-4,8-9,12-15,29-36,61H,2,5-7,10-11,16-25,48-49H2,(H2,50,62)(H2,51,63)(H2,52,64)(H,53,66)(H,54,68)(H,55,71)(H,56,65)(H,57,69)(H,58,67)(H,59,70)/t29-,30-,31-,32-,33-,34-,35-,36-/m0/s1

InChIKey

NMQZTNQHZOPBHR-VTGDPKQBSA-N

Smiles

NCCCCC[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](Cc4ccccc4)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(=O)N)C(=O)N2)C(=O)NCC(=O)N