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N-[(1S)-2-[4-(3-aminopropylamino)butylamino]-1-hydroxy-2-oxoethyl]-7-(diaminomethylideneamino)heptanamide;trihydrochloride

N-[(1S)-2-[4-(3-aminopropylamino)butylamino]-1-hydroxy-2-oxoethyl]-7-(diaminomethylideneamino)heptanamide;trihydrochloride structure

CAS No:
84937-45-1
Formula:
C17H40Cl3N7O3
Chemical Name:
N-[(1S)-2-[4-(3-aminopropylamino)butylamino]-1-hydroxy-2-oxoethyl]-7-(diaminomethylideneamino)heptanamide;trihydrochloride
Synonyms:
Deoxyspergualin trihydrochloride;UNII-S0D7V00ZRX;(-)-15-Deoxyspergualin trihydrochloride;(-)-Gusperimus trihydrochloride;84937-45-1;S0D7V00ZRX;N-[(1S)-2-[4-(3-aminopropylamino)butylamino]-1-hydroxy-2-oxoethyl]-7-(diaminomethylideneamino)heptanamide;trihydrochloride;Gusperimus (-)-form trihydrochloride;(-)-(15S)-1-Amino-19-guanidino-11,15-dihydroxy-4,9,12-triazanonadecane-10,13-dione 3HCl;DTXSID00233977;Heptanamide, 7-((aminoiminomethyl)amino)-N-((1S)-2-((4-((3-aminopropyl)amino)butyl)amino)-1-hydroxy-2-oxoethyl)-, trihydrochloride;Heptanamide, 7-((aminoiminomethyl)amino)-N-(2-((4-((3-aminopropyl)amino)butyl)amino)-1-hydroxy-2-oxoethyl)-, trihydrochloride, (-)-;Heptanamide, 7-((aminoiminomethyl)amino)-N-(2-((4-((3-aminopropyl)amino)butyl)amino)-1-hydroxy-2-oxoethyl)-, trihydrochloride, (S)-;Q27288397;UNII-QZS4144IO0 component AXSPHUWXYSZPBG-OKUPDQQSSA-N

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N-[(1S)-2-[4-(3-aminopropylamino)butylamino]-1-hydroxy-2-oxoethyl]-7-(diaminomethylideneamino)heptanamide;trihydrochloride Basic Attributes

Molecular Weight：

496.9 g/mol

Exact Mass：

495.225821 g/mol

UNII：

S0D7V00ZRX

DSSTox ID：

DTXSID00233977

Characteristics

PSA：

181 Å²

Computed Properties

Molecular Weight:496.9
Hydrogen Bond Donor Count:10
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:17
Exact Mass:495.225821
Monoisotopic Mass:495.225821
Topological Polar Surface Area:181
Heavy Atom Count:30
Complexity:429
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:4
Compound Is Canonicalized:Yes

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Guide of N-[(1S)-2-[4-(3-aminopropylamino)butylamino]-1-hydroxy-2-oxoethyl]-7-(diaminomethylideneamino)heptanamide;trihydrochloride

Basic Attributes
Characteristics
Computed Properties

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