Deamino Arginine Vasopressin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 34
Total Number of Articles : 63
PubChem 5311065
Molecular Formula

C46H64N14O12S2

SMILES

C1C[C@H](N(C1)C(=O)[C@@H]2CSSCCC(=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)C(=O)N[C@H](CCCN=C(N)N)C(=O)NCC(=O)N

InChI

InChI=1S/C46H64N14O12S2/c47-35(62)15-14-29-40(67)58-32(22-36(48)63)43(70)59-33(45(72)60-18-5-9-34(60)44(71)56-28(8-4-17-52-46(50)51)39(66)53-23-37(49)64)24-74-73-19-16-38(65)54-30(21-26-10-12-27(61)13-11-26)41(68)57-31(42(69)55-29)20-25-6-2-1-3-7-25/h1-3,6-7,10-13,28-34,61H,4-5,8-9,14-24H2,(H2,47,62)(H2,48,63)(H2,49,64)(H,53,66)(H,54,65)(H,55,69)(H,56,71)(H,57,68)(H,58,67)(H,59,70)(H4,50,51,52)/t28-,29+,30+,31+,32+,33+,34+/m1/s1

synonyms
  • DESMOPRESSIN
  • 16679-58-6
  • Desmopresina
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Properties
Property Value
MW 1069.2 g/mol
HBD 13
HBA 15
Rotatable Bond Count 19
Exact Mass 1068.42695588 g/mol
Monoisotopic Mass 1068.42695588 g/mol
Heavy Atom Count 74
Isotope Atom Count 0
Atom Stereo Count 7
Covalent Unit Count 1
Complexity 2040
xlogp -4
Topological Polar Surface Area 489