THEOPHYLLINE ANHYDROUS

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H8N4O2
Molecular Weight	180.164
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of THEOPHYLLINE ANHYDROUS

Structure Search

SMILES

CN1C2=C(N=CN2)C(=O)N(C)C1=O

InChI

InChIKey=ZFXYFBGIUFBOJW-UHFFFAOYSA-N

InChI=1S/C7H8N4O2/c1-10-5-4(8-3-9-5)6(12)11(2)7(10)13/h3H,1-2H3,(H,8,9)

HIDE SMILES / InChI

Approval Year

Name

Type

Language

THEOPHYLLINE ANHYDROUS

Common Name

English

PENTOXIFYLLINE IMPURITY C [EP IMPURITY]

Common Name

English

Theophylline [WHO-DD]

Common Name

English

1,3-DIMETHYLXANTHINE

Systematic Name

English

THEOPHYLLINE,ANHYDROUS [VANDF]

Common Name

English

THEOPHYLLINE [USP-RS]

Common Name

English

THEOPHYLLINE [MI]

Common Name

English

THEOPHYLLINE, ANHYDROUS

Common Name

English

NSC-2066

Code

English

THEOPHYLLINE ANHYDROUS [HSDB]

Common Name

English

DIMENHYDRINATE IMPURITY A [EP IMPURITY]

Common Name

English

THEOPHYLLINE MELTING POINT STANDARD

Common Name

English

DOXOPHYLLINE METABOLITE M3

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C319

Created by admin on Fri Dec 15 15:56:01 UTC 2023 , Edited by admin on Fri Dec 15 15:56:01 UTC 2023

NCI_THESAURUS

C221

Created by admin on Fri Dec 15 15:56:01 UTC 2023 , Edited by admin on Fri Dec 15 15:56:01 UTC 2023

NDF-RT

N0000008118

Created by admin on Fri Dec 15 15:56:01 UTC 2023 , Edited by admin on Fri Dec 15 15:56:01 UTC 2023

NDF-RT

N0000175790

Created by admin on Fri Dec 15 15:56:01 UTC 2023 , Edited by admin on Fri Dec 15 15:56:01 UTC 2023

WHO-ATC

R03DB02

Created by admin on Fri Dec 15 15:56:01 UTC 2023 , Edited by admin on Fri Dec 15 15:56:01 UTC 2023

NDF-RT

N0000008118

Created by admin on Fri Dec 15 15:56:01 UTC 2023 , Edited by admin on Fri Dec 15 15:56:01 UTC 2023

Code System Code Type Description

NSC

2066

Created by admin on Fri Dec 15 15:56:01 UTC 2023 , Edited by admin on Fri Dec 15 15:56:01 UTC 2023

PRIMARY

EVMPD

SUB40136

Created by admin on Fri Dec 15 15:56:01 UTC 2023 , Edited by admin on Fri Dec 15 15:56:01 UTC 2023

PRIMARY

SMS_ID

100000091484

Created by admin on Fri Dec 15 15:56:01 UTC 2023 , Edited by admin on Fri Dec 15 15:56:01 UTC 2023

PRIMARY

DRUG BANK

DB00277

Created by admin on Fri Dec 15 15:56:01 UTC 2023 , Edited by admin on Fri Dec 15 15:56:01 UTC 2023

PRIMARY

FDA UNII

0I55128JYK

Created by admin on Fri Dec 15 15:56:01 UTC 2023 , Edited by admin on Fri Dec 15 15:56:01 UTC 2023

PRIMARY

MERCK INDEX

m10706

Created by admin on Fri Dec 15 15:56:01 UTC 2023 , Edited by admin on Fri Dec 15 15:56:01 UTC 2023

PRIMARY

Merck Index

HSDB

3399

Created by admin on Fri Dec 15 15:56:01 UTC 2023 , Edited by admin on Fri Dec 15 15:56:01 UTC 2023

PRIMARY

RXCUI

91178

Created by admin on Fri Dec 15 15:56:01 UTC 2023 , Edited by admin on Fri Dec 15 15:56:01 UTC 2023

PRIMARY

RxNorm

DAILYMED

0I55128JYK

Created by admin on Fri Dec 15 15:56:01 UTC 2023 , Edited by admin on Fri Dec 15 15:56:01 UTC 2023

PRIMARY

CAS

58-55-9

Created by admin on Fri Dec 15 15:56:01 UTC 2023 , Edited by admin on Fri Dec 15 15:56:01 UTC 2023

PRIMARY

EPA CompTox

DTXSID5021336

Created by admin on Fri Dec 15 15:56:01 UTC 2023 , Edited by admin on Fri Dec 15 15:56:01 UTC 2023

PRIMARY

CHEBI

28177

Created by admin on Fri Dec 15 15:56:01 UTC 2023 , Edited by admin on Fri Dec 15 15:56:01 UTC 2023

PRIMARY

ECHA (EC/EINECS)

200-385-7

Created by admin on Fri Dec 15 15:56:01 UTC 2023 , Edited by admin on Fri Dec 15 15:56:01 UTC 2023

PRIMARY

EVMPD

SUB15516MIG

Created by admin on Fri Dec 15 15:56:01 UTC 2023 , Edited by admin on Fri Dec 15 15:56:01 UTC 2023

PRIMARY

PUBCHEM

2153

Created by admin on Fri Dec 15 15:56:01 UTC 2023 , Edited by admin on Fri Dec 15 15:56:01 UTC 2023

PRIMARY

NCI_THESAURUS

C61968

Created by admin on Fri Dec 15 15:56:01 UTC 2023 , Edited by admin on Fri Dec 15 15:56:01 UTC 2023

PRIMARY

RS_ITEM_NUM

1653117

Created by admin on Fri Dec 15 15:56:01 UTC 2023 , Edited by admin on Fri Dec 15 15:56:01 UTC 2023

PRIMARY

ACTIVE MOIETY


					0I55128JYK

THEOPHYLLINE ANHYDROUS

METABOLITE ACTIVE (PARENT)


					3G6A5W338E

CAFFEINE

METABOLITE ACTIVE (PARENT)


					WS6X982OEC

3-METHYLXANTHINE

METABOLITE INACTIVE (PARENT)


					2WS4HQ639J

1-METHYLURIC ACID

METABOLITE INACTIVE (PARENT)


					C222JTI9I3

1,3-DIMETHYLURIC ACID

PARENT (METABOLITE)


					MPM23GMO7Z

SALT/SOLVATE (PARENT)


					GB901PL1KW

SALT/SOLVATE (PARENT)


					C229N9DX94

AMINOPHYLLINE DIHYDRATE

SALT/SOLVATE (PARENT)


					X3D62BXX1R

THEOPHYLLINE DIETHANOLAMINE

SALT/SOLVATE (PARENT)


					AVI4QY17K7

THEOPHYLLINE-BETAINE

SALT/SOLVATE (PARENT)


					9Z1S0O31SL

THEOPHYLLINE OLAMINE

SALT/SOLVATE (PARENT)


					88AO1K4HJ3

THEOPHYLLINE SODIUM ACETATE

SALT/SOLVATE (PARENT)


					5T3F96XMN1

MAGNESIUM THEOPHYLLINE

SALT/SOLVATE (PARENT)


					C137DTR5RG

SALT/SOLVATE (PARENT)


					Y7E0LU9ZMS

AMINOPHYLLINE MONOHYDRATE

SALT/SOLVATE (PARENT)


					27Y3KJK423

SALT/SOLVATE (PARENT)


					LS5I9ST4B9

THEOPHYLLINE NICOTINATE

SALT/SOLVATE (PARENT)


					VOU5V0B772

SALT/SOLVATE (PARENT)


					O196W99W6K

LYSINE THEOPHYLLINE

SALT/SOLVATE (PARENT)


					VWZ980637N

THEOPHYLLINE CALCIUM SALICYLATE

SALT/SOLVATE (PARENT)


					1442U7XKHA

THEOPHYLLINE MEGLUMINE

SALT/SOLVATE (PARENT)


					3K045XR58X

SALT/SOLVATE (PARENT)


					Z26UUE8X7L

THEOPHYLLINE AMINOBENZOIC ACID

SALT/SOLVATE (PARENT)


					2S36N8T753

THEOPHYLLINE SODIUM GLYCINATE