DIARCTIGENIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C42H46O12
Molecular Weight	742.8074
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=CC=C(C[C@H]2COC(=O)[C@@H]2CC3=CC(=C(O)C(OC)=C3)C4=C(O)C(OC)=CC(C[C@@H]5[C@@H](CC6=CC(OC)=C(OC)C=C6)COC5=O)=C4)C=C1OC

InChI

InChIKey=XYMRYKOVQDOJFH-VZNYXHRGSA-N

InChI=1S/C42H46O12/c1-47-33-9-7-23(17-35(33)49-3)11-27-21-53-41(45)29(27)13-25-15-31(39(43)37(19-25)51-5)32-16-26(20-38(52-6)40(32)44)14-30-28(22-54-42(30)46)12-24-8-10-34(48-2)36(18-24)50-4/h7-10,15-20,27-30,43-44H,11-14,21-22H2,1-6H3/t27-,28-,29+,30+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C42H46O12
Molecular Weight	742.8074
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

PubMed

Title	Date	PubMed
Diarctigenin, a lignan constituent from Arctium lappa, down-regulated zymosan-induced transcription of inflammatory genes through suppression of DNA binding ability of nuclear factor-kappaB in macrophages.	2008-11	18694995

Substance Class	Chemical Created by `admin` on `Mon Mar 31 20:06:19 GMT 2025` Edited by `admin` on `Mon Mar 31 20:06:19 GMT 2025`
Record UNII	HC1O9LXQ32
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(-)-DIARCTIGENIN

Preferred Name

English

DIARCTIGENIN

Common Name

English

2(3H)-FURANONE, 3,3'-((6,6'-DIHYDROXY-5,5'-DIMETHOXY(1,1'-BIPHENYL)-3,3'-DIYL)BIS(METHYLENE))BIS(DIHYDRO-4-((3,4-DIMETHOXYPHENYL)METHYL)-, (3R-(3.ALPHA.(3'R*,4'R*),4.BETA.))-

Common Name

English

DIARCTIGENIN, (-)-

Common Name

English

Code System Code Type Description

FDA UNII

HC1O9LXQ32

Created by admin on Mon Mar 31 20:06:19 GMT 2025 , Edited by admin on Mon Mar 31 20:06:19 GMT 2025

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PUBCHEM

16215736

Created by admin on Mon Mar 31 20:06:19 GMT 2025 , Edited by admin on Mon Mar 31 20:06:19 GMT 2025

PRIMARY

CAS

160433-41-0

Created by admin on Mon Mar 31 20:06:19 GMT 2025 , Edited by admin on Mon Mar 31 20:06:19 GMT 2025

PRIMARY

EPA CompTox

DTXSID90166881

Created by admin on Mon Mar 31 20:06:19 GMT 2025 , Edited by admin on Mon Mar 31 20:06:19 GMT 2025

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