Stacofylline

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H33N7O3
Molecular Weight	419.5211
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Stacofylline

Structure Search

SMILES

CCN(CC)C(=O)N1CCN(CCCC2=NC3=C(N2C)C(=O)N(C)C(=O)N3C)CC1

InChI

InChIKey=PKXWXHGLEXOSQK-UHFFFAOYSA-N

InChI=1S/C20H33N7O3/c1-6-26(7-2)20(30)27-13-11-25(12-14-27)10-8-9-15-21-17-16(22(15)3)18(28)24(5)19(29)23(17)4/h6-14H2,1-5H3

HIDE SMILES / InChI

Molecular Formula	C20H33N7O3
Molecular Weight	419.5211
Charge	0
Count

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

Description
Sources: https://worldwide.espacenet.com/publicationDetails/biblio?DB=EPODOC&II=0&ND=3&adjacent=true&locale=en_EP&FT=D&date=19850724&CC=EP&NR=0149578A2&KC=A2

Stacofylline is a xanthine derivative patented by ADIR for the treatment of migraine and asthenia.

Originator

Approval Year

Patents

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 18:28:40 GMT 2025` Edited by `admin` on `Mon Mar 31 18:28:40 GMT 2025`
Record UNII	C7K8PK4Q0E
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

Stacofylline

Official Name

English

S-9977

Preferred Name

English

stacofylline [INN]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C319

Created by admin on Mon Mar 31 18:28:40 GMT 2025 , Edited by admin on Mon Mar 31 18:28:40 GMT 2025

Code System Code Type Description

INN

7354

Created by admin on Mon Mar 31 18:28:40 GMT 2025 , Edited by admin on Mon Mar 31 18:28:40 GMT 2025

PRIMARY

EVMPD

SUB10639MIG

Created by admin on Mon Mar 31 18:28:40 GMT 2025 , Edited by admin on Mon Mar 31 18:28:40 GMT 2025

PRIMARY

EPA CompTox

DTXSID90869325

Created by admin on Mon Mar 31 18:28:40 GMT 2025 , Edited by admin on Mon Mar 31 18:28:40 GMT 2025

PRIMARY

NCI_THESAURUS

C74224

Created by admin on Mon Mar 31 18:28:40 GMT 2025 , Edited by admin on Mon Mar 31 18:28:40 GMT 2025

PRIMARY

PUBCHEM

132157

Created by admin on Mon Mar 31 18:28:40 GMT 2025 , Edited by admin on Mon Mar 31 18:28:40 GMT 2025

PRIMARY

CAS

98833-92-2

Created by admin on Mon Mar 31 18:28:40 GMT 2025 , Edited by admin on Mon Mar 31 18:28:40 GMT 2025

PRIMARY

SMS_ID

100000083832

Created by admin on Mon Mar 31 18:28:40 GMT 2025 , Edited by admin on Mon Mar 31 18:28:40 GMT 2025

PRIMARY

ChEMBL

CHEMBL2107536

Created by admin on Mon Mar 31 18:28:40 GMT 2025 , Edited by admin on Mon Mar 31 18:28:40 GMT 2025

PRIMARY

FDA UNII

C7K8PK4Q0E

Created by admin on Mon Mar 31 18:28:40 GMT 2025 , Edited by admin on Mon Mar 31 18:28:40 GMT 2025

PRIMARY

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