LIGUSTILIDE A

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H14O2
Molecular Weight	190.2388
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCC/C(/[H])=C\1/C2=C(C=CCC2)C(=O)O1

InChI

InChIKey=IQVQXVFMNOFTMU-FLIBITNWSA-N

InChI=1S/C12H14O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h5,7-8H,2-4,6H2,1H3/b11-8-

HIDE SMILES / InChI

Molecular Formula	C12H14O2
Molecular Weight	190.2388
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Jun 26 10:56:54 UTC 2021` Edited by `admin` on `Sat Jun 26 10:56:54 UTC 2021`
Record UNII	10HE68JD06
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

LIGUSTILIDE A

Common Name

English

(Z)-LIGUSTILIDE

Common Name

English

(3Z)-3-BUTYLIDENE-4,5-DIHYDRO-1(3H)-ISOBENZOFURANONE

Common Name

English

1(3H)-ISOBENZOFURANONE, 3-BUTYLIDENE-4,5-DIHYDRO-, (3Z)-

Common Name

English

LIGUSTILIDE

Common Name

English

CIS-LIGUSTILIDE

Common Name

English

1(3H)-ISOBENZOFURANONE, 3-BUTYLIDENE-4,5-DIHYDRO-, (Z)-

Common Name

English

Code System Code Type Description

FDA UNII

10HE68JD06

Created by admin on Sat Jun 26 10:56:55 UTC 2021 , Edited by admin on Sat Jun 26 10:56:55 UTC 2021

PRIMARY

CAS

4431-01-0

Created by admin on Sat Jun 26 10:56:54 UTC 2021 , Edited by admin on Sat Jun 26 10:56:54 UTC 2021

NON-SPECIFIC STEREOCHEMISTRY

CAS

81944-09-4

Created by admin on Sat Jun 26 10:56:55 UTC 2021 , Edited by admin on Sat Jun 26 10:56:55 UTC 2021

PRIMARY

PUBCHEM

5319022

Created by admin on Sat Jun 26 10:56:55 UTC 2021 , Edited by admin on Sat Jun 26 10:56:55 UTC 2021

PRIMARY

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