Structural formula
Business number | 0373 |
---|---|
Molecular formula | C46H65N15O12S2 |
Molecular weight | 1084.23 |
label |
vasopressin acetate, β-Hypophamine, Antidiuretic hormone, Enzymes·Proteins·Peptides |
Numbering system
CAS number:113-79-1
MDL number:MFCD00133939
EINECS number:204-035-4
RTECS number:None
BRN number:None
PubChem number:24900773
Physical property data
None yet
Toxicological data
None yet
Ecological data
None yet
Molecular structure data
5. Molecular property data:
1. Molar refractive index: 270.08
2. Molar Volume (m3/mol):680.6
3. Isotonic specific volume (90.2K): 2013.4
4. Surface Tension (dyne/cm):76.5
5. Polarizability(10-24cm3):107.07
Compute chemical data
1. Hydrophobic parameters Calculate reference value (XlogP):-4.8
2. Hydrogen Bonding Number of donors: 14
3. Hydrogen Bonding Number of receptors: 16
4. Rotatable Number of chemical bonds: 19
5. Interchange Number of isomers: 1001
6. Topological molecules Polar surface area (TPSA):464
7. Heavy atoms Quantity: 75
8. Surface charge :0
9. 3. Number of hydrogen bond acceptors: 16
4. Rotatable Number of chemical bonds: 19
5. Interchange Number of isomers: 1001
6. Topological molecules Polar surface area (TPSA):464
7. Heavy atoms Quantity: 75
8. Surface charge :0
9. Complexity :2070
10. Number of isotope atoms:0
11. Determine the number of atomic stereocenters:0
12. Uncertain number of atomic stereocenters:8
13. Determine the number of stereocenters of chemical bonds:0
14. Uncertain number of chemical bond stereocenters:0
15. Number of covalent bond units: 1
Properties and stability
None yet
Storage method
None yet
Synthesis method
None yet
Purpose
None yet
e=”FONT-SIZE: 9pt; FONT-FAMILY: 宋体; mso-bidi-font-family: Arial; mso-ascii-font-family: Arial; mso-hansi-font-family: Arial”>Complexity:2070
10. Number of isotope atoms:0
11. Determine the number of atomic stereocenters:0
12. Uncertain number of atomic stereocenters:8
13. Determine the number of stereocenters of chemical bonds:0
14. Uncertain number of chemical bond stereocenters:0
15. Number of covalent bond units: 1
Properties and stability
None yet
Storage method
None yet
Synthesis method
None yet
Purpose
None yet