Suberenol

Details

Stereochemistry	ACHIRAL
Molecular Formula	C15H16O4
Molecular Weight	260.2851
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=C(\C=C\C(C)(C)O)C=C2C=CC(=O)OC2=C1

InChI

InChIKey=LNFVZUMSDAIQDQ-VOTSOKGWSA-N

InChI=1S/C15H16O4/c1-15(2,17)7-6-11-8-10-4-5-14(16)19-13(10)9-12(11)18-3/h4-9,17H,1-3H3/b7-6+

HIDE SMILES / InChI

Molecular Formula	C15H16O4
Molecular Weight	260.2851
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 `Wed Apr 02 07:11:31 GMT 2025` Edited by `admin` on `Wed Apr 02 07:11:31 GMT 2025`
Record UNII	TT3D5CTA3P
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Suberenol

Common Name

English

(E)-Suberenol

Preferred Name

English

2H-1-Benzopyran-2-one, 6-[(1E)-3-hydroxy-3-methyl-1-butenyl]-7-methoxy-

Systematic Name

English

7-METHOXY-6-(3-METHYL-3-OXIDANYL-BUT-1-ENYL)CHROMEN-2-ONE

Systematic Name

English

6-(3-Hydroxy-3-methyl-1-buten-1-yl)-7-methoxy-2H-1-benzopyran-2-one

Systematic Name

English

trans-Suberenol

Common Name

English

2H-1-Benzopyran-2-one, 6-[(1E)-3-hydroxy-3-methyl-1-buten-1-yl]-7-methoxy-

Systematic Name

English

2H-1-Benzopyran-2-one, 6-(3-hydroxy-3-methyl-1-butenyl)-7-methoxy-

Systematic Name

English

Coumarin, 6-(3-hydroxy-3-methyl-1-butenyl)-7-methoxy-, (E)-

Systematic Name

English

6-[(1E)-3-Hydroxy-3-methyl-1-buten-1-yl]-7-methoxy-2H-1-benzopyran-2-one

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID701318629