Products 80952-47-2

CAS 80952-47-2 appears in our catalog under these names: Spergualin trihydrochloride, 98%, Spergualin trihydrochloride, Spergualin (trihydrochloride). Offered by: Chemat Brand, GLPBio, MedChemExpress. Available pack sizes: on request, 1mg, Get quote.

(3S)-N-[(1S)-2-[4-(3-aminopropylamino)butylamino]-1-hydroxy-2-oxoethyl]-7-(diaminomethylideneamino)-3-hydroxyheptanamide;trihydrochloride (CAS 80952-47-2) is a chemical compound with the molecular formula C17H40Cl3N7O4 and a molecular weight of 512.9 g/mol. IUPAC name: (3S)-N-[(1S)-2-[4-(3-aminopropylamino)butylamino]-1-hydroxy-2-oxoethyl]-7-(diaminomethylideneamino)-3-hydroxyheptanamide;trihydrochloride. InChIKey: XWNJZPKETIWTTF-RIHGSVRJSA-N.

Identity
Molecular formulaC17H40Cl3N7O4
Molecular weight512.9 g/mol
IUPAC name(3S)-N-[(1S)-2-[4-(3-aminopropylamino)butylamino]-1-hydroxy-2-oxoethyl]-7-(diaminomethylideneamino)-3-hydroxyheptanamide;trihydrochloride
InChIKeyXWNJZPKETIWTTF-RIHGSVRJSA-N
SMILESC(CCN=C(N)N)C[C@@H](CC(=O)N[C@H](C(=O)NCCCCNCCCN)O)O.Cl.Cl.Cl

Computed by PubChem (NCBI)