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Substance Name: 1H-Pyrrolo(2,3-f)quinoline-2,7,9-tricarboxamide, 4,5-dihydro-N,N,N',N',N'',N''-hexamethyl-4,5-dioxo-
RN: 112881-58-0
InChIKey: MQJRXCAANWGXFK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H21-N5-O5

Molecular Weight

  • 411.4159
 
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Names and Synonyms

Synonym

  • PQQ tri(dimethylamide)

Systematic Name

  • 1H-Pyrrolo(2,3-f)quinoline-2,7,9-tricarboxamide, 4,5-dihydro-N,N,N',N',N'',N''-hexamethyl-4,5-dioxo-

Registry Numbers

CAS Registry Number

  • 112881-58-0

System Generated Number

  • 0112881580

Structure Descriptors

InChI

1S/C20H21N5O5/c1-23(2)18(28)9-7-11(19(29)24(3)4)22-15-13(9)14-10(16(26)17(15)27)8-12(21-14)20(30)25(5)6/h7-8,21H,1-6H3

InChIKey

MQJRXCAANWGXFK-UHFFFAOYSA-N

Smiles

CN(C)C(=O)c1cc(nc2c1-c3c(cc([nH]3)C(=O)N(C)C)C(=O)C2=O)C(=O)N(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 5gm/kg (5000mg/kg)   United States Patent Document. Vol. #4898870,
mouse LD50 subcutaneous > 1500mg/kg (1500mg/kg)   United States Patent Document. Vol. #4898870,
rat LD50 oral > 5gm/kg (5000mg/kg)   United States Patent Document. Vol. #4898870,
rat LD50 subcutaneous > 1500mg/kg (1500mg/kg)   United States Patent Document. Vol. #4898870,