GLYASPERIN D

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H26O5
Molecular Weight	370.4388
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=CC2=C(C[C@@H](CO2)C3=C(O)C=C(O)C=C3)C(OC)=C1CC=C(C)C

InChI

InChIKey=DDMAUIOCNQXFHL-AWEZNQCLSA-N

InChI=1S/C22H26O5/c1-13(2)5-7-17-20(25-3)11-21-18(22(17)26-4)9-14(12-27-21)16-8-6-15(23)10-19(16)24/h5-6,8,10-11,14,23-24H,7,9,12H2,1-4H3/t14-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C22H26O5
Molecular Weight	370.4388
Charge	0
Count

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

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Synthesis of rotavirus mRNA 1 Target ID: Synthesis of rotavirus mRNA Sources: https://www.ncbi.nlm.nih.gov/pubmed/20850329	Inhibitor 8297
Peroxisome proliferator-activated receptor gamma 111 Target ID: CHEMBL235 Sources: DOI: 10.1016/j.bmcl.2003.09.052	Binding Agent 1064

PubMed

Title	Date	PubMed

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:55:56 UTC 2023` Edited by `admin` on `Sat Dec 16 09:55:56 UTC 2023`
Record UNII	T6ZF2ZY8CW
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

GLYASPERIN D

Common Name

English

1,3-BENZENEDIOL, 4-(3,4-DIHYDRO-5,7-DIMETHOXY-6-(3-METHYL-2-BUTENYL)-2H-1-BENZOPYRAN-3-YL)-, (R)-

Common Name

English

4-((3R)-3,4-DIHYDRO-5,7-DIMETHOXY-6-(3-METHYL-2-BUTEN-1-YL)-2H-1-BENZOPYRAN-3-YL)-1,3-BENZENEDIOL

Systematic Name

English

1,3-BENZENEDIOL, 4-((3R)-3,4-DIHYDRO-5,7-DIMETHOXY-6-(3-METHYL-2-BUTEN-1-YL)-2H-1-BENZOPYRAN-3-YL)-

Systematic Name

English

Code System Code Type Description

FDA UNII

T6ZF2ZY8CW

Created by admin on Sat Dec 16 09:55:56 UTC 2023 , Edited by admin on Sat Dec 16 09:55:56 UTC 2023

PRIMARY

CAS

142561-10-2

Created by admin on Sat Dec 16 09:55:56 UTC 2023 , Edited by admin on Sat Dec 16 09:55:56 UTC 2023

PRIMARY

PUBCHEM

480860

Created by admin on Sat Dec 16 09:55:56 UTC 2023 , Edited by admin on Sat Dec 16 09:55:56 UTC 2023

PRIMARY

EPA CompTox

DTXSID80931525

Created by admin on Sat Dec 16 09:55:56 UTC 2023 , Edited by admin on Sat Dec 16 09:55:56 UTC 2023

PRIMARY

Related Record Type Details


					42B5YD8F0K

GLYCYRRHIZA URALENSIS ROOT

PARENT -> CONSTITUENT ALWAYS PRESENT

Comments:

GLYASPERIN D exhibited antimicrobial activity (MICs 3.13?12.5 ug/ml) against MSSAs (strains FDA 209P and Smith) and MRSAs(strains K3 and ST 28).

Amount:


					42B5YD8F0K

GLYCYRRHIZA URALENSIS ROOT

PARENT -> CONSTITUENT ALWAYS PRESENT

Amount: