1,4,7-Trioxacycloundecane-8,11-dione

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H12O5
Molecular Weight	188.1779
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1,4,7-Trioxacycloundecane-8,11-dione

Structure Search

SMILES

O=C1CCC(=O)OCCOCCO1

InChI

InChIKey=QKQPBZPCABVALD-UHFFFAOYSA-N

InChI=1S/C8H12O5/c9-7-1-2-8(10)13-6-4-11-3-5-12-7/h1-6H2

HIDE SMILES / InChI

Molecular Formula	C8H12O5
Molecular Weight	188.1779
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 `Tue Apr 01 17:37:18 GMT 2025` Edited by `admin` on `Tue Apr 01 17:37:18 GMT 2025`
Record UNII	PJ3J67R547
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1,4,7-Trioxacycloundecane-8,11-dione

Preferred Name

English

Code System Code Type Description

ECHA (EC/EINECS)

230-891-3

Created by admin on Tue Apr 01 17:37:18 GMT 2025 , Edited by admin on Tue Apr 01 17:37:18 GMT 2025

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EPA CompTox

DTXSID00223772

Created by admin on Tue Apr 01 17:37:18 GMT 2025 , Edited by admin on Tue Apr 01 17:37:18 GMT 2025

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CAS

7357-94-0

Created by admin on Tue Apr 01 17:37:18 GMT 2025 , Edited by admin on Tue Apr 01 17:37:18 GMT 2025

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PUBCHEM

81819

Created by admin on Tue Apr 01 17:37:18 GMT 2025 , Edited by admin on Tue Apr 01 17:37:18 GMT 2025

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FDA UNII

PJ3J67R547

Created by admin on Tue Apr 01 17:37:18 GMT 2025 , Edited by admin on Tue Apr 01 17:37:18 GMT 2025

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