8-ETHOXYCAFFEINE

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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 8-ETHOXYCAFFEINE

Structure Search

SMILES

CCOC1=NC2=C(N1C)C(=O)N(C)C(=O)N2C

InChI

InChIKey=LCYXNYNRVOBSHK-UHFFFAOYSA-N

InChI=1S/C10H14N4O3/c1-5-17-9-11-7-6(12(9)2)8(15)14(4)10(16)13(7)3/h5H2,1-4H3

HIDE SMILES / InChI

Molecular Formula	C10H14N4O3
Molecular Weight	238.2432
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 17:29:48 GMT 2023` Edited by `admin` on `Fri Dec 15 17:29:48 GMT 2023`
Record UNII	271190XI98
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

8-ETHOXYCAFFEINE

Systematic Name

English

ETHOXYCAFFEINE, 8-

Systematic Name

English

NSC-8812

Code

English

Code System Code Type Description

EPA CompTox

DTXSID20206406

Created by admin on Fri Dec 15 17:29:48 GMT 2023 , Edited by admin on Fri Dec 15 17:29:48 GMT 2023

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FDA UNII

271190XI98

Created by admin on Fri Dec 15 17:29:48 GMT 2023 , Edited by admin on Fri Dec 15 17:29:48 GMT 2023

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NSC

8812

Created by admin on Fri Dec 15 17:29:48 GMT 2023 , Edited by admin on Fri Dec 15 17:29:48 GMT 2023

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PUBCHEM

11347

Created by admin on Fri Dec 15 17:29:48 GMT 2023 , Edited by admin on Fri Dec 15 17:29:48 GMT 2023

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CAS

577-66-2

Created by admin on Fri Dec 15 17:29:48 GMT 2023 , Edited by admin on Fri Dec 15 17:29:48 GMT 2023

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MESH

C020899

Created by admin on Fri Dec 15 17:29:48 GMT 2023 , Edited by admin on Fri Dec 15 17:29:48 GMT 2023

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