7-(3-HYDROXYPROPYL)THEOPHYLLINE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H14N4O3
Molecular Weight	238.2432
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 7-(3-HYDROXYPROPYL)THEOPHYLLINE

Structure Search

SMILES

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

InChI

InChIKey=QCGRMMZPZDAITA-UHFFFAOYSA-N

InChI=1S/C10H14N4O3/c1-12-8-7(9(16)13(2)10(12)17)14(6-11-8)4-3-5-15/h6,15H,3-5H2,1-2H3

HIDE SMILES / InChI

Approval Year

Name

Type

Language

7-(3-HYDROXYPROPYL)THEOPHYLLINE

Systematic Name

English

THEOPHYLLINE, 7-(3-HYDROXYPROPYL)-

Systematic Name

English

7-(.GAMMA.-HYDROXYPROPYL)THEOPHYLLINE

Systematic Name

English

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

Systematic Name

English

NSC-60290

Code

English

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

Systematic Name

English

X-991

Code

English

Code System Code Type Description

CAS

23146-04-5

Created by admin on Sat Dec 16 12:28:01 GMT 2023 , Edited by admin on Sat Dec 16 12:28:01 GMT 2023

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EPA CompTox

DTXSID80177724

Created by admin on Sat Dec 16 12:28:01 GMT 2023 , Edited by admin on Sat Dec 16 12:28:01 GMT 2023

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NSC

60290

Created by admin on Sat Dec 16 12:28:01 GMT 2023 , Edited by admin on Sat Dec 16 12:28:01 GMT 2023

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PUBCHEM

90016

Created by admin on Sat Dec 16 12:28:01 GMT 2023 , Edited by admin on Sat Dec 16 12:28:01 GMT 2023

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FDA UNII

Q5WZC3H2AY

Created by admin on Sat Dec 16 12:28:01 GMT 2023 , Edited by admin on Sat Dec 16 12:28:01 GMT 2023

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ECHA (EC/EINECS)

245-453-7

Created by admin on Sat Dec 16 12:28:01 GMT 2023 , Edited by admin on Sat Dec 16 12:28:01 GMT 2023

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SUBSTANCE RECORD


					Q5WZC3H2AY

7-(3-HYDROXYPROPYL)THEOPHYLLINE