ACEFYLLINE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H10N4O4
Molecular Weight	238.2001
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ACEFYLLINE

Structure Search

SMILES

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

InChI

InChIKey=HCYFGRCYSCXKNQ-UHFFFAOYSA-N

InChI=1S/C9H10N4O4/c1-11-7-6(8(16)12(2)9(11)17)13(4-10-7)3-5(14)15/h4H,3H2,1-2H3,(H,14,15)

HIDE SMILES / InChI

Molecular Formula	C9H10N4O4
Molecular Weight	238.2001
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:39:27 UTC 2023` Edited by `admin` on `Fri Dec 15 15:39:27 UTC 2023`
Record UNII	M494UE2YEP
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ACEFYLLINE

Common Name

English

CAFFEINE CARBOXYLIC ACID

Official Name

English

7H-PURINE-7-ACETIC ACID, 1,2,3,6-TETRAHYDRO-1,3-DIMETHYL-2,6-DIOXO-

Common Name

English

CAFFEINE CARBOXYLIC ACID [INCI]

Common Name

English

Acefylline [WHO-DD]

Common Name

English

7-THEOPHYLLINEACETIC ACID

Systematic Name

English

NSC-52996

Code

English

1,2,3,6-TETRAHYDRO-1,3-DIMETHYL-2,6-DIOXOPURINE-7-ACETIC A

Common Name

English

THEOPHYLLINE-7-ACETIC ACID

Systematic Name

English

DOXOPHYLLINE METABOLITE M2

Common Name

English

ACEFYLLINE [MI]

Common Name

English

ACEPHYLLINE

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C319

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

Code System Code Type Description

EVMPD

SUB00243MIG

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

PRIMARY

DRUG BANK

DB13573

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

PRIMARY

MERCK INDEX

m1295

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

PRIMARY

Merck Index

SMS_ID

100000078825

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

PRIMARY

WIKIPEDIA

ACEFYLLINE

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

PRIMARY

PUBCHEM

69550

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

PRIMARY

DRUG CENTRAL

49

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

PRIMARY

EPA CompTox

DTXSID6057796

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

PRIMARY

MESH

C019140

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

PRIMARY

ECHA (EC/EINECS)

211-490-2

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

PRIMARY

FDA UNII

M494UE2YEP

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

PRIMARY

NSC

52996

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

PRIMARY

NCI_THESAURUS

C96200

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

PRIMARY

CAS

652-37-9

Created by admin on Fri Dec 15 15:39:27 UTC 2023 , Edited by admin on Fri Dec 15 15:39:27 UTC 2023

PRIMARY

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Acefylline prenylamine

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Amount:


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ACEFYLLINE PIPERAZINE

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ACEFYLLINE SODIUM

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					M494UE2YEP

ACTIVE MOIETY