CIMICIFUGIC ACID F

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H20O10
Molecular Weight	432.3775
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=CC=C(\C=C\C(=O)O[C@H](C(O)=O)[C@](O)(CC2=CC=C(O)C=C2)C(O)=O)C=C1O

InChI

InChIKey=WBGMKAAMRFEBHK-PZTMCFHLSA-N

InChI=1S/C21H20O10/c1-30-16-8-4-12(10-15(16)23)5-9-17(24)31-18(19(25)26)21(29,20(27)28)11-13-2-6-14(22)7-3-13/h2-10,18,22-23,29H,11H2,1H3,(H,25,26)(H,27,28)/b9-5+/t18-,21-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C21H20O10
Molecular Weight	432.3775
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 20:23:35 GMT 2025` Edited by `admin` on `Mon Mar 31 20:23:35 GMT 2025`
Record UNII	5586G4WLE3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CIMICIFUGIC ACID F

Common Name

English

BUTANEDIOIC ACID, 2-HYDROXY-3-(((2E)-3-(3-HYDROXY-4-METHOXYPHENYL)-1-OXO-2-PROPEN-1-YL)OXY)-2-((4-HYDROXYPHENYL)METHYL)-, (2R,3S)-

Preferred Name

English

BUTANEDIOIC ACID, 2-HYDROXY-3-(((2E)-3-(3-HYDROXY-4-METHOXYPHENYL)-1-OXO-2-PROPENYL)OXY)-2-((4-HYDROXYPHENYL)METHYL)-, (2R,3S)-

Common Name

English

CIMICIFUGIC ACID F, (+)-

Common Name

English

Code System Code Type Description

FDA UNII

5586G4WLE3

Created by admin on Mon Mar 31 20:23:35 GMT 2025 , Edited by admin on Mon Mar 31 20:23:35 GMT 2025

PRIMARY

PUBCHEM

6450179

Created by admin on Mon Mar 31 20:23:35 GMT 2025 , Edited by admin on Mon Mar 31 20:23:35 GMT 2025

PRIMARY

CAS

220618-91-7

Created by admin on Mon Mar 31 20:23:35 GMT 2025 , Edited by admin on Mon Mar 31 20:23:35 GMT 2025

PRIMARY

EPA CompTox

DTXSID301353233

Created by admin on Mon Mar 31 20:23:35 GMT 2025 , Edited by admin on Mon Mar 31 20:23:35 GMT 2025

PRIMARY

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