| CAS Number | 77928-70-2 |
| Catalog Number | AG00GGVE(AGN-PC-0UCMN2) |
| Chemical Name | N¹-Acetylspermine trihydrochloride |
| IUPAC Name | N-[3-[4-(3-aminopropylamino)butylamino]propyl]acetamide;trihydrochloride |
| InChI | InChI=1S/C12H28N4O.3ClH/c1-12(17)16-11-5-10-15-8-3-2-7-14-9-4-6-13;;;/h14-15H,2-11,13H2,1H3,(H,16,17);3*1H |
| InChI Key | QQSPUTBJDXPUCR-UHFFFAOYSA-N |
| MDL Number | MFCD00083219 |
| Molecular Formula | C12H31Cl3N4O |
| Molecular Weight | 353.7597 |
| SMILES | CC(NCCCNCCCCNCCCN)=O.Cl.Cl.Cl |
| Synonyms | N1-Acetylspermine trihydrochloride,
77928-70-2,
acetylspermine trihydrochloride,
FT-0720976,
C-55160,
N1-Acetylspermine trihydrochloride, >=97.0% (TLC),
N-(3-(4-(3-aminopropylamino)butylamino)propyl)acetamide trihydrochloride,
N1-ACETYLSPERMINETRIHYDROCHLORIDE,
|
| Complexity | 176 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 4 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 352.156g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 7 |
| Isotope Atom Count | 0 |
| Molecular Weight | 353.757g/mol |
| Monoisotopic Mass | 352.156g/mol |
| Rotatable Bond Count | 12 |
| Topological Polar Surface Area | 79.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number