RefChem:239100

bis(3-carboxy-3,5-dihydroxy-5-oxopentanoate);2-[2-[3-[2-(diethylazaniumyl)ethoxycarbonyl]-2-methyl-1-phenylindol-5-yl]oxyacetyl]oxyethyl-diethylazanium

Also Known As: RefChem:239100|AC1L18JN|1H-Indole-3-carboxylic acid, 5-(2-(2-(diethylamino)ethoxy)-2-oxoethoxy)-2-methyl-1-phenyl-, 2-(diethylamino)ethyl ester, dicitrate|1-Phenyl-2-methyl-3-carboxyindolyl-5-hydroxyacetic acid bis-diethylaminoethyl ester dicitrate|3-Carboxy-3,5-dihydroxy-5-oxopentanoate;2-[5-[2-[2-(diethylazaniumyl)ethoxy]-2-oxoethoxy]-2-methyl-1-phenylindole-3-carbonyl]oxyethyl-diethylazanium|1H-INDOLE-3-CARBOXYLIC ACID, 5-(2-(2-(DIETHYLAMINO)ETHOXY)-2-OXOETHOXY)-2-METHYL|2-({[(3-{[2-(Diethylazaniumyl)ethoxy]carbonyl}-2-methyl-1-phenyl-1H-indol-5-yl)oxy]acetyl}oxy)-N,N-diethylethan-1-aminium bis(3,4-dicarboxy-3-hydroxybutanoate)|3-carboxy-3,5-dihydroxy-5-oxopentanoate; 2-[2-[3-[2-(diethylazaniumyl)ethoxycarbonyl]-2-methyl-1-phenylindol-5-yl]oxyacetyl]oxyethyl-diethylazanium

Molecular Formula	C42H57N3O19
Molecular Weight	907.35864 g/mol
LogP	-3.3
Topological Polar Surface Area	345.56 Ų
Hydrogen Bond Donors	8
Hydrogen Bond Acceptors	16
Rotatable Bonds	25
Exact Mass	907.35864
Heavy Atoms	64
Complexity	1974.6

Chemical Identifiers

CAS Number	68360-94-1
SMILES	CC[NH+](CC)CCOC(=O)COC1=CC2=C(C=C1)N(C(=C2C(=O)OCC[NH+](CC)CC)C)C3=CC=CC=C3.C(C(=O)O)C(CC(=O)[O-])(C(=O)O)O.C(C(=O)O)C(CC(=O)[O-])(C(=O)O)O