Arginine Vasopressin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 165
Total Number of Articles : 124
PubChem 644077
Molecular Formula

C46H65N15O12S2

SMILES

C1C[C@H](N(C1)C(=O)[C@@H]2CSSC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N2)CC(=O)N)CCC(=O)N)CC3=CC=CC=C3)CC4=CC=C(C=C4)O)N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(=O)N

InChI

InChI=1S/C46H65N15O12S2/c47-27-22-74-75-23-33(45(73)61-17-5-9-34(61)44(72)56-28(8-4-16-53-46(51)52)39(67)54-21-37(50)65)60-43(71)32(20-36(49)64)59-40(68)29(14-15-35(48)63)55-41(69)31(18-24-6-2-1-3-7-24)58-42(70)30(57-38(27)66)19-25-10-12-26(62)13-11-25/h1-3,6-7,10-13,27-34,62H,4-5,8-9,14-23,47H2,(H2,48,63)(H2,49,64)(H2,50,65)(H,54,67)(H,55,69)(H,56,72)(H,57,66)(H,58,70)(H,59,68)(H,60,71)(H4,51,52,53)/t27-,28-,29-,30-,31-,32-,33-,34-/m0/s1

synonyms
  • ARGIPRESSIN
  • Arginine vasopressin
  • 113-79-1
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Properties
Property Value
MW 1084.2 g/mol
HBD 14
HBA 16
Rotatable Bond Count 19
Exact Mass 1083.43785492 g/mol
Monoisotopic Mass 1083.43785492 g/mol
Heavy Atom Count 75
Isotope Atom Count 0
Atom Stereo Count 8
Covalent Unit Count 1
Complexity 2070
xlogp -4.8
Topological Polar Surface Area 515