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Details

Stereochemistry ACHIRAL
Molecular Formula C15H18N6O2.C6H5NO2
Molecular Weight 437.4518
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PIMEPHYLLINE NICOTINATE

SMILES

OC(=O)C1=CC=CN=C1.CN2C3=C(N(CCNCC4=CC=CN=C4)C=N3)C(=O)N(C)C2=O

InChI

InChIKey=DOWFKBHYDXGGML-UHFFFAOYSA-N
InChI=1S/C15H18N6O2.C6H5NO2/c1-19-13-12(14(22)20(2)15(19)23)21(10-18-13)7-6-17-9-11-4-3-5-16-8-11;8-6(9)5-2-1-3-7-4-5/h3-5,8,10,17H,6-7,9H2,1-2H3;1-4H,(H,8,9)

HIDE SMILES / InChI
There are a few information in the literature about pimephylline nicotinate. The metabolites of this compound were determined in the rats.

Approval Year

PubMed

PubMed

TitleDatePubMed
[Determination of metabolites of pimefyllin nicotinate in rat's urine].
1974 Sep
Name Type Language
PIMEPHYLLINE NICOTINATE
Common Name English
THEOPHYLLINE, 7-(2-((3-PYRIDYLMETHYL)AMINO)ETHYL)-, NICOTINATE
Systematic Name English
PIMEFYLLINE NICOTINATE
MI  
Common Name English
NICOTINIC ACID, COMPD. WITH 7-(2-((3-PYRIDYLMETHYL)AMINO)ETHYL)THEOPHYLLINE
Common Name English
1H-PURINE-2,6-DIONE, 3,7-DIHYDRO-1,3-DIMETHYL-7-(2-((3-PYRIDINYLMETHYL)AMINO)ETHYL)-, MONO-3-PYRIDINECARBOXYLATE
Systematic Name English
3-PYRIDINECARBOXYLIC ACID, COMPD. WITH 3,7-DIHYDRO-1,3-DIMETHYL-7-(2-((3-PYRIDINYLMETHYL)AMINO)ETHYL)-1H-PURINE-2,6-DIONE (1:1)
Common Name English
NICOTINIC ACID, COMPD. WITH 7-(2-((3-PYRIDYLMETHYL)AMINO)ETHYL)THEOPHYLLINE (1:1)
Common Name English
Theophylline nicotinate [WHO-DD]
Common Name English
TEONICON
Brand Name English
PIMEFYLLINE NICOTINATE [MI]
Common Name English
ES-902
Code English
7-(.BETA.-PICOLYLAMINOETHYL)THEOPHYLLINE NICOTINATE
Systematic Name English
Code System Code Type Description
FDA UNII
8Y694512DA
Created by admin on Sat Dec 16 06:43:26 GMT 2023 , Edited by admin on Sat Dec 16 06:43:26 GMT 2023
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PUBCHEM
197889
Created by admin on Sat Dec 16 06:43:26 GMT 2023 , Edited by admin on Sat Dec 16 06:43:26 GMT 2023
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EPA CompTox
DTXSID90143399
Created by admin on Sat Dec 16 06:43:26 GMT 2023 , Edited by admin on Sat Dec 16 06:43:26 GMT 2023
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ECHA (EC/EINECS)
233-185-3
Created by admin on Sat Dec 16 06:43:26 GMT 2023 , Edited by admin on Sat Dec 16 06:43:26 GMT 2023
PRIMARY
CAS
10058-07-8
Created by admin on Sat Dec 16 06:43:26 GMT 2023 , Edited by admin on Sat Dec 16 06:43:26 GMT 2023
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MERCK INDEX
m8812
Created by admin on Sat Dec 16 06:43:26 GMT 2023 , Edited by admin on Sat Dec 16 06:43:26 GMT 2023
PRIMARY Merck Index