CIMICIFUGIC ACID A

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H20O11
Molecular Weight	448.3769
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

SMILES

COC1=C(O)C=CC(\C=C\C(=O)O[C@H](C(O)=O)[C@](O)(CC2=CC(O)=C(O)C=C2)C(O)=O)=C1

InChI

InChIKey=LIJMMUDJSMCVDJ-ZHBFVYIWSA-N

InChI=1S/C21H20O11/c1-31-16-9-11(2-6-14(16)23)4-7-17(25)32-18(19(26)27)21(30,20(28)29)10-12-3-5-13(22)15(24)8-12/h2-9,18,22-24,30H,10H2,1H3,(H,26,27)(H,28,29)/b7-4+/t18-,21-/m1/s1

HIDE SMILES / InChI

Approval Year

Show entries

Name

Type

Language

CIMICIFUGA ACID A

Preferred Name

English

CIMICIFUGIC ACID A

Common Name

English

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

Systematic Name

English

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

Systematic Name

English

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

Systematic Name

English

Showing 1 to 5 of 6 entries

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Code System

Code

Type

Description

EPA CompTox

DTXSID101347721

PRIMARY

CAS

205114-65-4

PRIMARY

FDA UNII

0S0MJU107Z

PRIMARY

PUBCHEM

6449879

PRIMARY

Showing 1 to 4 of 4 entries

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SUBSTANCE RECORD


					0S0MJU107Z

CIMICIFUGIC ACID A