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Substance Name: Vasopressin, 1-deamino-(8-lysine(N(6)-tetramethylrhodamylaminothiocarbonyl))-
RN: 123298-17-9
InChIKey: CPFMSSKPEGMFOD-UHFFFAOYSA-N

Molecular Weight

  • 1484.74
 
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Names and Synonyms

Name of Substance

  • Vasopressin, 1-deamino-(8-lysine(N(6)-tetramethylrhodamylaminothiocarbonyl))-

Synonyms

  • 1-Deamino-(8-lysine(N(6)-tetramethylrhodamylaminothiocarbonyl))vasopressin
  • TR-Lvp

Registry Numbers

CAS Registry Number

  • 123298-17-9

System Generated Number

  • 0123298179

Structure Descriptors

InChI

1S/C71H85N15O15S3/c1-84(2)42-18-23-46-56(34-42)101-57-35-43(85(3)4)19-24-47(57)62(46)45-22-17-41(33-48(45)70(99)100)77-71(102)75-28-9-8-13-49(63(92)76-37-60(74)90)80-68(97)55-14-10-29-86(55)69(98)54-38-104-103-30-27-61(91)78-51(32-40-15-20-44(87)21-16-40)65(94)81-52(31-39-11-6-5-7-12-39)66(95)79-50(25-26-58(72)88)64(93)82-53(36-59(73)89)67(96)83-54/h5-7,11-12,15-24,33-35,49-55H,8-10,13-14,25-32,36-38H2,1-4H3,(H16-,72,73,74,75,76,77,78,79,80,81,82,83,87,88,89,90,91,92,93,94,95,96,97,99,100,102)

InChIKey

CPFMSSKPEGMFOD-UHFFFAOYSA-N

Smiles

S=C(NCCCC[C@@H](NC([C@@H]1CCCN1C(=O)[C@@H]1CSSCCC(N[C@@H](C(N[C@@H](C(N[C@@H](C(N[C@@H](C(=O)N1)CC(N)=O)=O)CCC(=O)N)=O)Cc1ccccc1)=O)Cc1ccc(cc1)O)=O)=O)C(=O)NCC(N)=O)Nc1cc(c(cc1)c1c2c([o+]c3c1ccc(c3)N(C)C)cc(cc2)N(C)C)C([O-])=O