ISOANGUSTONE A

Details

Stereochemistry	ACHIRAL
Molecular Formula	C25H26O6
Molecular Weight	422.4703
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)=CCC1=CC(=CC(O)=C1O)C2=COC3=CC(O)=C(CC=C(C)C)C(O)=C3C2=O

InChI

InChIKey=QNLGNISMYMFVHP-UHFFFAOYSA-N

InChI=1S/C25H26O6/c1-13(2)5-7-15-9-16(10-20(27)23(15)28)18-12-31-21-11-19(26)17(8-6-14(3)4)24(29)22(21)25(18)30/h5-6,9-12,26-29H,7-8H2,1-4H3

HIDE SMILES / InChI

Molecular Formula	C25H26O6
Molecular Weight	422.4703
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:06:01 GMT 2025` Edited by `admin` on `Mon Mar 31 22:06:01 GMT 2025`
Record UNII	58NM254N9T
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ISOANGUSTONE A

Common Name

English

3-(3,4-DIHYDROXY-5-(3-METHYL-2-BUTEN-1-YL)PHENYL)-5,7-DIHYDROXY-6-(3-METHYL-2-BUTEN-1-YL)-4H-1-BENZOPYRAN-4-ONE

Preferred Name

English

4H-1-BENZOPYRAN-4-ONE, 3-(3,4-DIHYDROXY-5-(3-METHYL-2-BUTEN-1-YL)PHENYL)-5,7-DIHYDROXY-6-(3-METHYL-2-BUTEN-1-YL)-

Systematic Name

English

4H-1-BENZOPYRAN-4-ONE, 3-(3,4-DIHYDROXY-5-(3-METHYL-2-BUTENYL)PHENYL)-5,7-DIHYDROXY-6-(3-METHYL-2-BUTENYL)-

Systematic Name

English

Code System Code Type Description

FDA UNII

58NM254N9T

Created by admin on Mon Mar 31 22:06:01 GMT 2025 , Edited by admin on Mon Mar 31 22:06:01 GMT 2025

PRIMARY

CAS

129280-34-8

Created by admin on Mon Mar 31 22:06:01 GMT 2025 , Edited by admin on Mon Mar 31 22:06:01 GMT 2025

PRIMARY

EPA CompTox

DTXSID401317327

Created by admin on Mon Mar 31 22:06:01 GMT 2025 , Edited by admin on Mon Mar 31 22:06:01 GMT 2025

PRIMARY

PUBCHEM

21591148

Created by admin on Mon Mar 31 22:06:01 GMT 2025 , Edited by admin on Mon Mar 31 22:06:01 GMT 2025

PRIMARY

Related Record Type Details


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GLYCYRRHIZA URALENSIS ROOT

PARENT -> ACTIVE CONSTITUENT ALWAYS PRESENT

Comments:

The compound showed strong ferric reducing activities and effectively scavenged DPPH, ABTS+, and singlet oxygen radicals.

Amount: