CITREOTHIOPYRANE B

Details

Stereochemistry	RACEMIC
Molecular Formula	C11H14O4S
Molecular Weight	242.291
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CO\C(=C\C(O)=O)C1=C(C)SC(C)CC1=O

InChI

InChIKey=MQEPEJSTEZZWEE-WEVVVXLNSA-N

InChI=1S/C11H14O4S/c1-6-4-8(12)11(7(2)16-6)9(15-3)5-10(13)14/h5-6H,4H2,1-3H3,(H,13,14)/b9-5+

HIDE SMILES / InChI

Molecular Formula	C11H14O4S
Molecular Weight	242.291
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	1
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 20:46:41 GMT 2025` Edited by `admin` on `Tue Apr 01 20:46:41 GMT 2025`
Record UNII	QTJ6UVU5D9
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CITREOTHIOLACTONE

Preferred Name

English

CITREOTHIOPYRANE B

Common Name

English

CITREOTHIOLACTONE-

Common Name

English

(2E)-(+)-3-(3,4-DIHYDRO-2,6-DIMETHYL-4-OXO-2H-THIOPYRAN-5-YL)-3-METHOXY-2-PROPENOIC ACID

Systematic Name

English

(E)-3-(2,6-DIMETHYL-4-OXO-2,3-DIHYDROTHIOPYRAN-5-YL)-3-METHOXY-PROP-2-ENOIC ACID

Systematic Name

English

2-PROPENOIC ACID, 3-(3,4-DIHYDRO-2,6-DIMETHYL-4-OXO-2H-THIOPYRAN-5-YL)-3-METHOXY-, (2E)-(+)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

21673208

Created by admin on Tue Apr 01 20:46:41 GMT 2025 , Edited by admin on Tue Apr 01 20:46:41 GMT 2025

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CAS

86277-72-7

Created by admin on Tue Apr 01 20:46:41 GMT 2025 , Edited by admin on Tue Apr 01 20:46:41 GMT 2025

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FDA UNII

QTJ6UVU5D9

Created by admin on Tue Apr 01 20:46:41 GMT 2025 , Edited by admin on Tue Apr 01 20:46:41 GMT 2025

PRIMARY