7-DEMETHYLSUBEROSIN

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C14H14O3
Molecular Weight	230.2592
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 7-DEMETHYLSUBEROSIN

Structure Search

SMILES

CC(C)=CCC1=C(O)C=C2OC(=O)C=CC2=C1

InChI

InChIKey=FIDUIAPDSKSUGO-UHFFFAOYSA-N

InChI=1S/C14H14O3/c1-9(2)3-4-10-7-11-5-6-14(16)17-13(11)8-12(10)15/h3,5-8,15H,4H2,1-2H3

HIDE SMILES / InChI

Approval Year

Name

Type

Language

7-DEMETHYLSUBEROSIN

Common Name

English

7-HYDROXY-6-(3-METHYL-2-BUTEN-1-YL)-2H-1-BENZOPYRAN-2-ONE

Systematic Name

English

2H-1-BENZOPYRAN-2-ONE, 7-HYDROXY-6-(3-METHYL-2-BUTEN-1-YL)-

Systematic Name

English

DEMETHYLSUBEROSIN

Systematic Name

English

2H-1-BENZOPYRAN-2-ONE, 7-HYDROXY-6-(3-METHYL-2-BUTENYL)-

Systematic Name

English

COUMARIN, 7-HYDROXY-6-(3-METHYL-2-BUTENYL)-

Systematic Name

English

6-(DIMETHYLALLYL)UMBELLIFERONE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID90175695

Created by admin on Sat Dec 16 12:20:15 GMT 2023 , Edited by admin on Sat Dec 16 12:20:15 GMT 2023

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FDA UNII

SDM71QIW25

Created by admin on Sat Dec 16 12:20:15 GMT 2023 , Edited by admin on Sat Dec 16 12:20:15 GMT 2023

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PUBCHEM

5316525

Created by admin on Sat Dec 16 12:20:15 GMT 2023 , Edited by admin on Sat Dec 16 12:20:15 GMT 2023

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CHEBI

69042

Created by admin on Sat Dec 16 12:20:15 GMT 2023 , Edited by admin on Sat Dec 16 12:20:15 GMT 2023

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CAS

21422-04-8

Created by admin on Sat Dec 16 12:20:15 GMT 2023 , Edited by admin on Sat Dec 16 12:20:15 GMT 2023

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SUBSTANCE RECORD


					SDM71QIW25

7-DEMETHYLSUBEROSIN