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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H21N5O4.C6H5NO2
Molecular Weight 434.4463
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of XANTINOL NICOTINATE, (S)-

SMILES

OC(=O)C1=CN=CC=C1.CN(CCO)C[C@H](O)CN2C=NC3=C2C(=O)N(C)C(=O)N3C

InChI

InChIKey=GEPMAHVDJHFBJI-FVGYRXGTSA-N
InChI=1S/C13H21N5O4.C6H5NO2/c1-15(4-5-19)6-9(20)7-18-8-14-11-10(18)12(21)17(3)13(22)16(11)2;8-6(9)5-2-1-3-7-4-5/h8-9,19-20H,4-7H2,1-3H3;1-4H,(H,8,9)/t9-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C6H5NO2
Molecular Weight 123.1094
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C13H21N5O4
Molecular Weight 311.3369
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:26:44 GMT 2023
Edited
by admin
on Sat Dec 16 10:26:44 GMT 2023
Record UNII
5BW6T3CFFK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
XANTINOL NICOTINATE, (S)-
Common Name English
SADAMINE, (S)-
Brand Name English
COMPLAMIN, (S)-
Brand Name English
7-(2-HYDROXY-3-(N-METHYL-N-(2-HYDROXYETHYL)AMINO)-PROPYL)-THEOPHYLLINE NICOTINATE, (S)-
Systematic Name English
COMPLAMEX, (S)-
Brand Name English
VEDRIN, (S)-
Brand Name English
ANGIOMIN, (S)-
Brand Name English
3-PYRIDINECARBOXYLIC ACID, COMPD. WITH 3,7-DIHYDRO-7-(2-HYDROXY-3-((2-HYDROXYETHYL)METHYLAMINO)PROPYL)-1,3-DIMETHYL-1H-PURINE-2,6-DIONE (1:1), (S)-
Systematic Name English
XAVIN, (S)-
Brand Name English
THEOPHYLLINE, 7-(2-HYDROXY-3-((2-HYDROXYETHYL)METHYLAMINO)PROPYL)-, MONONICOTINATE (SALT), (S)-
Systematic Name English
NICOTINIC ACID, COMPD. WITH 7-(2-HYDROXY-3-((2-HYDROXYETHYL)METHYLAMINO)PROPYL)THEOPHYLLINE (1:1), (S)-
Systematic Name English
THEOPHYLLINE, 7-(2-HYDROXY-3-((2-HYDROXYETHYL)METHYLAMINO)PROPYL)-, NICOTINATE, (S)-
Systematic Name English
XANTHINOL NIACINATE, (S)-
Common Name English
1H-PURINE-2,6-DIONE, 3,7-DIHYDRO-7-(2-HYDROXY-3-((2-HYDROXYETHYL)METHYLAMINO)PROPYL)-1,3-DIMETHYL-, MONO-3-PYRIDINECARBOXYLATE (SALT), (S)-
Systematic Name English
NSC-113217, (S)-
Code English
TEONICOL, (S)-
Brand Name English
XANTHINOL NICOTINATE, (S)-
Common Name English
7-(2-HYDROXY-3-(N-(2-HYDROXYETHYL)-N-METHYLAMINO)PROPYL)-1,3-DIMETHYLXANTHINE PYRIDINE-3-CARBOXYLATE, (S)-
Systematic Name English
LANDRINA 300, (S)-
Brand Name English
SK-331A, (S)-
Code English
7-(3-(METHYL-2-HYDROXYETHYLAMINO)-2-HYDROXYPROPYL))THEOPHYLLINE NICOTINATE, (S)-
Systematic Name English
7-(2-HYDROXY-3-((2-HYDROXYETHYL)METHYLAMINO)PROPYL)THEOPHYLLINE NICOTINATE, (S)-
Systematic Name English
COMPLAMIN RETARD, (S)-
Brand Name English
STENALGIL, (S)-
Brand Name English
CONTAMEX, (S)-
Brand Name English
ANGIOAMIN, (S)-
Brand Name English
Code System Code Type Description
FDA UNII
5BW6T3CFFK
Created by admin on Sat Dec 16 10:26:44 GMT 2023 , Edited by admin on Sat Dec 16 10:26:44 GMT 2023
PRIMARY
PUBCHEM
24867449
Created by admin on Sat Dec 16 10:26:44 GMT 2023 , Edited by admin on Sat Dec 16 10:26:44 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER