STIPITATONIC ACID

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H4O6
Molecular Weight	208.1245
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of STIPITATONIC ACID

Structure Search

SMILES

OC1=CC(=O)C(O)=CC2=C1C(=O)OC2=O

InChI

InChIKey=IECSWTFJOUGQFO-UHFFFAOYSA-N

InChI=1S/C9H4O6/c10-4-1-3-7(6(12)2-5(4)11)9(14)15-8(3)13/h1-2,12H,(H,10,11)

HIDE SMILES / InChI

Molecular Formula	C9H4O6
Molecular Weight	208.1245
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 `Mon Mar 31 19:56:12 GMT 2025` Edited by `admin` on `Mon Mar 31 19:56:12 GMT 2025`
Record UNII	IXT44W5O7C
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

NSC-149772

Preferred Name

English

STIPITATONIC ACID

Common Name

English

1H-CYCLOHEPTA(C)FURAN-1,3,6-TRIONE, 4,7-DIHYDROXY-

Systematic Name

English

4,7-DIHYDROXY-1H-CYCLOHEPTA(C)FURAN-1,3,6-TRIONE

Systematic Name

English

1,3,6-CYCLOHEPTATRIENE-1,2-DICARBOXYLIC ANHYDRIDE, 3,6-DIHYDROXY-5-OXO-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID50209405

Created by admin on Mon Mar 31 19:56:12 GMT 2025 , Edited by admin on Mon Mar 31 19:56:12 GMT 2025

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CAS

606-39-3

Created by admin on Mon Mar 31 19:56:12 GMT 2025 , Edited by admin on Mon Mar 31 19:56:12 GMT 2025

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PUBCHEM

98579

Created by admin on Mon Mar 31 19:56:12 GMT 2025 , Edited by admin on Mon Mar 31 19:56:12 GMT 2025

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CHEBI

16445

Created by admin on Mon Mar 31 19:56:12 GMT 2025 , Edited by admin on Mon Mar 31 19:56:12 GMT 2025

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FDA UNII

IXT44W5O7C

Created by admin on Mon Mar 31 19:56:12 GMT 2025 , Edited by admin on Mon Mar 31 19:56:12 GMT 2025

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NSC

149772

Created by admin on Mon Mar 31 19:56:12 GMT 2025 , Edited by admin on Mon Mar 31 19:56:12 GMT 2025

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