1-(3,4-DIHYDROXYPHENYL)-4,4-DIMETHYL-1-PENTEN-3-OL

Details

Stereochemistry	RACEMIC
Molecular Formula	C13H18O3
Molecular Weight	222.2802
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 1-(3,4-DIHYDROXYPHENYL)-4,4-DIMETHYL-1-PENTEN-3-OL

Structure Search

SMILES

CC(C)(C)C(O)\C=C\C1=CC(O)=C(O)C=C1

InChI

InChIKey=BUCYIZKIFHMFOW-FNORWQNLSA-N

InChI=1S/C13H18O3/c1-13(2,3)12(16)7-5-9-4-6-10(14)11(15)8-9/h4-8,12,14-16H,1-3H3/b7-5+

HIDE SMILES / InChI

Approval Year

Name

Type

Language

1-(3,4-DIHYDROXYPHENYL)-4,4-DIMETHYL-1-PENTEN-3-OL

Systematic Name

English

BRN 2262937

Code

English

LS-136426

Code

English

4-(4,4-DIMETHYL-3-HYDROXY-1-PENTENYL)PYROCATECHOL

Systematic Name

English

SURECN12336486

Code

English

PYROCATECHOL, 4-(4,4-DIMETHYL-3-HYDROXY-1-PENTENYL)-

Systematic Name

English

AC1O6554

Code

English

4-((E)-3-HYDROXY-4,4-DIMETHYLPENT-1-ENYL)BENZENE-1,2-DIOL

Systematic Name

English

1,2-BENZENEDIOL, 4-(3-HYDROXY-4,4-DIMETHYL-1-PENTENYL)-

Systematic Name

English

1,2-BENZENEDIOL, 4-(3-HYDROXY-4,4-DIMETHYL-1-PENTEN-1-YL)-

Systematic Name

English

STIRIPENTOL METABOLITE II

Common Name

English

Code System Code Type Description

FDA UNII

8DW74NE7UU

Created by admin on Sat Dec 16 08:20:04 GMT 2023 , Edited by admin on Sat Dec 16 08:20:04 GMT 2023

PRIMARY

PUBCHEM

6446800

Created by admin on Sat Dec 16 08:20:04 GMT 2023 , Edited by admin on Sat Dec 16 08:20:04 GMT 2023

PRIMARY

CAS

66596-49-4

Created by admin on Sat Dec 16 08:20:04 GMT 2023 , Edited by admin on Sat Dec 16 08:20:04 GMT 2023

PRIMARY

PARENT (METABOLITE INACTIVE)


					R02XOT8V8I

STIRIPENTOL

SUBSTANCE RECORD


					8DW74NE7UU

1-(3,4-DIHYDROXYPHENYL)-4,4-DIMETHYL-1-PENTEN-3-OL