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Details

Stereochemistry RACEMIC
Molecular Formula C17H21N5O5
Molecular Weight 375.3791
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of THEODRENALINE

SMILES

CN1C2=C(N(CCNCC(O)C3=CC=C(O)C(O)=C3)C=N2)C(=O)N(C)C1=O

InChI

InChIKey=WMCMJIGLYZDKRN-UHFFFAOYSA-N
InChI=1S/C17H21N5O5/c1-20-15-14(16(26)21(2)17(20)27)22(9-19-15)6-5-18-8-13(25)10-3-4-11(23)12(24)7-10/h3-4,7,9,13,18,23-25H,5-6,8H2,1-2H3

HIDE SMILES / InChI
Molecular Formula C17H21N5O5
Molecular Weight 375.3791
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Description

THEODRENALINE, a theophylline derivative, is a cardiac stimulant. A 20:1 mixture of cafedrine and THEODRENALINE (AKRINOR®) is widely used in Germany for the treatment of hypotensive states during anesthesia and in emergency medicine.

Approval Year

Unknown
139,594

PubMed

Substance Class Chemical
Record UNII
RW8PD99T8G
Record Status Validated (UNII)
Record Version
NIH
NCATS
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