8-ISOPROPYLTHEOPHYLLINE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H14N4O2
Molecular Weight	222.2438
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 8-ISOPROPYLTHEOPHYLLINE

Structure Search

SMILES

CC(C)C1=NC2=C(N1)C(=O)N(C)C(=O)N2C

InChI

InChIKey=NKNVOKGUNUZJFC-UHFFFAOYSA-N

InChI=1S/C10H14N4O2/c1-5(2)7-11-6-8(12-7)13(3)10(16)14(4)9(6)15/h5H,1-4H3,(H,11,12)

HIDE SMILES / InChI

Approval Year

Name

Type

Language

8-ISOPROPYLTHEOPHYLLINE

Systematic Name

English

NSC-14303

Preferred Name

English

THEOPHYLLINE, 8-ISOPROPYL-

Systematic Name

English

1H-PURINE-2,6-DIONE, 3,7-DIHYDRO-1,3-DIMETHYL-8-(1-METHYLETHYL)-

Systematic Name

English

1H-PURINE-2,6-DIONE, 3,9-DIHYDRO-1,3-DIMETHYL-8-(1-METHYLETHYL)-

Systematic Name

English

3,9-DIHYDRO-1,3-DIMETHYL-8-(1-METHYLETHYL)-1H-PURINE-2,6-DIONE

Systematic Name

English

Code System Code Type Description

PUBCHEM

76103

Created by admin on Tue Apr 01 19:57:20 GMT 2025 , Edited by admin on Tue Apr 01 19:57:20 GMT 2025

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NSC

14303

Created by admin on Tue Apr 01 19:57:20 GMT 2025 , Edited by admin on Tue Apr 01 19:57:20 GMT 2025

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EPA CompTox

DTXSID30182722

Created by admin on Tue Apr 01 19:57:20 GMT 2025 , Edited by admin on Tue Apr 01 19:57:20 GMT 2025

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FDA UNII

3M1LJZ3U2S

Created by admin on Tue Apr 01 19:57:20 GMT 2025 , Edited by admin on Tue Apr 01 19:57:20 GMT 2025

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CAS

2850-40-0

Created by admin on Tue Apr 01 19:57:20 GMT 2025 , Edited by admin on Tue Apr 01 19:57:20 GMT 2025

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SUBSTANCE RECORD


					3M1LJZ3U2S

8-ISOPROPYLTHEOPHYLLINE