Basic information
- CAS
112935-96-3- Standard SMILES
NC(=O)CNC(=O)C(CCCN=C(N)N)NC(=O)C1CCCN1C(=O)C1CSSCC(N)C(=O)NC(Cc2ccc(O)cc2)C(=O)NC(Cc2ccccc2)C(=O)N2CC(O)CC2C(=O)NC(CC(N)=O)C(=O)N1- InChIKey
ZYPHFYVLPCRMHN-UHFFFAOYSA-N- Molecular formula
- C46H64N14O12S2
- Average molar mass
- 1,069.2 g/mol
- Monoisotopic mass
- 1,068.42695588
Overview
has antidiuretic activity
Names & identifiers
- Preferred name
- argipressin, hydroxy-Pro(4)-
- IUPAC
- 1-[9-amino-17-(2-amino-2-oxoethyl)-3-benzyl-22-hydroxy-6-[(4-hydroxyphenyl)methyl]-2,5,8,16,19-pentaoxo-11,12-dithia-1,4,7,15,18-pentazabicyclo[18.3.0]tricosane-14-carbonyl]-N-[1-[(2-amino-2-oxoethyl)amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]pyrrolidine-2-carboxamide
- English name
- argipressin, hydroxy-Pro(4)-
- Molecular formula
- C46H64N14O12S2
- Molecular weight
- 1069.22
Names & synonyms
Argipressin, hydroxy-pro(4)-112935-96-34-OH-Pro-avp4-Hydroxy-pro-argipressinArgipressin, hydroxyproline(4)-Arginine vasopressin, hydroxy-pho(4)-RefChem:1139791-[9-amino-17-(2-amino-2-oxoethyl)-3-benzyl-22-hydroxy-6-[(4-hydroxyphenyl)methyl]-2,5,8,16,19-pentaoxo-11,12-dithia-1,4,7,15,18-pentazabicyclo[18.3.0]tricosane-14-carbonyl]-N-[1-[(2-amino-2-oxoethyl)amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]pyrrolidine-2-carboxamideVasopressin, 4-(trans-4-hydroxy-L-proline)-8-L-arginine- (9CI)
Database identifiers
- CAS
112935-96-3- PubChem CID
- 194992
Properties
Computed structural properties
- XLogP
- -4.3
- Topological polar surface area
- 483 Ų
- Hydrogen bond donors
- 13
- Hydrogen bond acceptors
- 16
- Rotatable bonds
- 16
- Heavy atoms
- 74
- Formal charge
- 0
- Complexity
- 2,060
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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