Product Name

N-Dimethylaminoacetyl-partricin a 2-dimethylaminoethylamide Chemical Properties

 Molecule structure of N-Dimethylaminoacetyl-partricin a 2-dimethylaminoethylamide diaspartate (CAS NO.143563-20-6) : 

IUPAC Name: (2S)-2-aminobutanedioic acid;(1S,3R,4E,6E,8E,10Z,12Z,14E,16E,23R,27R,29R,31S,33S,35R,37S,38R)-3-[(2R,3S,4S,5S,6R)-4-[[2-(dimethylamino)acetyl]amino]-3,5-dihydroxy-6-methyloxan-2-yl]oxy-N-(2-dimethylaminoethyl)-23,27,29,31,33,35,37-heptahydroxy-19-[(2S)-5-hydroxy-7-[4-(methylamino)phenyl]-7-oxoheptan-2-yl]-18-methyl-21,25-dioxo-20,39-dioxabicyclo[33.3.1]nonatriaconta-4,6,8,10,12,14,16-heptaene-38-carboxamide 
Molecular Weight: 1548.76218 g/mol
Molecular Formula: C75H117N7O27 
Boiling Point: 1375.5 °C at 760 mmHg
Flash Point: 785.6 °C
Enthalpy of Vaporization: 218.23 kJ/mol
H-Bond Donor: 19
H-Bond Acceptor: 32
Rotatable Bond Count: 23
Tautomer Count: 84
Exact Mass: 1547.799742
MonoIsotopic Mass: 1547.799742
Topological Polar Surface Area: 568
Heavy Atom Count: 109
Complexity: 2560
Defined Atom StereoCenter Count: 18
Undefined Atom StereoCenter Count: 3
Defined Bond StereoCenter Count: 7
Covalently-Bonded Unit Count: 3
Isomeric SMILES: C[C@@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)O[C@@H]\2C[C@H]3[C@@H]([C@H](C[C@](O3)(C[C@H](C[C@H](C[C@H](C[C@H](CC(=O)C[C@H](CC(=O)OC(C(/C=C/C=C/C=C\C=C/C=C/C=C/C=C2)C)[C@@H](C)CCC(CC(=O)C4=CC=C(C=C4)NC)O)O)O)O)O)O)O)O)C(=O)NCCN(C)C)O)NC(=O)CN(C)C)O.C([C@@H](C(=O)O)N)C(=O)O.C([C@@H](C(=O)O)N)C(=O)O
InChIKey of N-Dimethylaminoacetyl-partricin a 2-dimethylaminoethylamide diaspartate (CAS NO.143563-20-6) : HJBVLNMWGIWYNV-OEDKZRDDSA-N

N-Dimethylaminoacetyl-partricin a 2-dimethylaminoethylamide Toxicity Data With Reference

1.    

ivn-mus LD50:46 mg/kg

    USXXAM    United States Patent Document. (Commissioner of Patents and Trademarks, Washington, DC 20231) #6143726 .

N-Dimethylaminoacetyl-partricin a 2-dimethylaminoethylamide Safety Profile

A poison by intravenous route. When heated to decomposition it emits toxic vapors of NOx.

N-Dimethylaminoacetyl-partricin a 2-dimethylaminoethylamide Specification

 N-Dimethylaminoacetyl-partricin a 2-dimethylaminoethylamide diaspartate (CAS NO.143563-20-6) is also called 21-(3,6-Dideoxy-3-(2-(dimethylamino)acetamido)-beta-D-mannopyranosyloxy)-N-(2-(dimethylamino)ethyl)-15,19-epoxy-
3,7,9,11,13,15,17,41-octahydroxy-36,38-dimethyl-43-(4-(methylamino)phenyl)-5,43-dioxo-22(E),24(E),26(E),28(E),30(E),32(E),34(E)-tritetracontaheptaeno-37-lactone diasparate ; SPA-S-753 ; L-Aspartic acid, compd. with 18-decarboxy-40-demethyl-3,7-dideoxo-N3'-((dimethylamino)acetyl]-18-(((2-(dimethylamino)ethyl)amino)carbonyl)-3,7-dihydroxy-N47-methyl-5-oxocandicidin D cyclic 15,19-hemiacetal (2:1) .

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