SPIROFYLLINE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C24H28N6O5
Molecular Weight	480.5163
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CN1C2=C(N(CC(=O)N3CC4(CCN(CCC5=CC=CC=C5)CC4)OC3=O)C=N2)C(=O)N(C)C1=O

InChI

InChIKey=DSRGPEAMMDAUGF-UHFFFAOYSA-N

InChI=1S/C24H28N6O5/c1-26-20-19(21(32)27(2)22(26)33)29(16-25-20)14-18(31)30-15-24(35-23(30)34)9-12-28(13-10-24)11-8-17-6-4-3-5-7-17/h3-7,16H,8-15H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C24H28N6O5
Molecular Weight	480.5163
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Description
Sources: https://www.medchemexpress.com/Spirofylline.html | https://apps.who.int/iris/bitstream/handle/10665/275695/WHO-EMP-RHT-TSN-2018.1-eng.pdf?sequence=1&isAllowed=y | https://www.ncbi.nlm.nih.gov/medgen/397436

Spirofylline, theophylline derivative, is a bronchodilator, which can be used to treat asthma and bronchitis and emphysema.

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Sat Dec 16 17:53:00 GMT 2023` Edited by `admin` on `Sat Dec 16 17:53:00 GMT 2023`
Record UNII	000F949089
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SPIROFYLLINE

Official Name

English

spirofylline [INN]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C319