PHASEOLLINISOFLAVAN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H20O4
Molecular Weight	324.3704
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1(C)OC2=CC=C([C@@H]3COC4=CC(O)=CC=C4C3)C(O)=C2C=C1

InChI

InChIKey=UUJBHSNXZMGYBT-ZDUSSCGKSA-N

InChI=1S/C20H20O4/c1-20(2)8-7-16-17(24-20)6-5-15(19(16)22)13-9-12-3-4-14(21)10-18(12)23-11-13/h3-8,10,13,21-22H,9,11H2,1-2H3/t13-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C20H20O4
Molecular Weight	324.3704
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:51:40 UTC 2023` Edited by `admin` on `Fri Dec 15 17:51:40 UTC 2023`
Record UNII	3A9F71823M
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PHASEOLLINISOFLAVAN

Common Name

English

(3,6'-BI-2H-1-BENZOPYRAN)-5',7-DIOL, 3,4-DIHYDRO-2',2'-DIMETHYL-, (3R)-

Systematic Name

English

(-)-PHASEOLLINISOFLAVAN

Common Name

English

PHASEOLINISOFLAVAN

Common Name

English

(3,6'-BI-2H-1-BENZOPYRAN)-5',7-DIOL, 3,4-DIHYDRO-2',2'-DIMETHYL-, (R)-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID60193326

Created by admin on Fri Dec 15 17:51:40 UTC 2023 , Edited by admin on Fri Dec 15 17:51:40 UTC 2023

PRIMARY

CAS

40323-57-7

Created by admin on Fri Dec 15 17:51:40 UTC 2023 , Edited by admin on Fri Dec 15 17:51:40 UTC 2023

PRIMARY

PUBCHEM

162412

Created by admin on Fri Dec 15 17:51:40 UTC 2023 , Edited by admin on Fri Dec 15 17:51:40 UTC 2023

PRIMARY

FDA UNII

3A9F71823M

Created by admin on Fri Dec 15 17:51:40 UTC 2023 , Edited by admin on Fri Dec 15 17:51:40 UTC 2023

PRIMARY

Related Record Type Details


					2788Z9758H

GLYCYRRHIZA GLABRA

PARENT -> CONSTITUENT ALWAYS PRESENT

Comments:

Minimum Inhibitory Concentration (MIC) for Staphylococcus aureus (ATCC 13709) = 25 mcg ml and Mycobacterium smegmatis (ATCC 6371) = 2.5 mcg ml. Extracts of G. glabra var. typica (Spanish licorice)-but not var. grandulifera (Russian licorice) were repeatedly active in the screen.