3,5-DIHYDROXY-7-METHOXY-2-(4-METHOXYPHENYL)-4-OXO-4H-1-BENZOPYRAN-8-YL BUTYRATE

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H20O8
Molecular Weight	400.3787
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3,5-DIHYDROXY-7-METHOXY-2-(4-METHOXYPHENYL)-4-OXO-4H-1-BENZOPYRAN-8-YL BUTYRATE

Structure Search

SMILES

CCCC(=O)OC1=C2OC(=C(O)C(=O)C2=C(O)C=C1OC)C3=CC=C(OC)C=C3

InChI

InChIKey=ZRKHWLRSNPTLPH-UHFFFAOYSA-N

InChI=1S/C21H20O8/c1-4-5-15(23)28-20-14(27-3)10-13(22)16-17(24)18(25)19(29-21(16)20)11-6-8-12(26-2)9-7-11/h6-10,22,25H,4-5H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C21H20O8
Molecular Weight	400.3787
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 12:26:45 GMT 2023` Edited by `admin` on `Sat Dec 16 12:26:45 GMT 2023`
Record UNII	JMA5THP22N
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3,5-DIHYDROXY-7-METHOXY-2-(4-METHOXYPHENYL)-4-OXO-4H-1-BENZOPYRAN-8-YL BUTYRATE

Systematic Name

English

NSC-363989

Code

English

Butanoic acid, 3,5-dihydroxy-7-methoxy-2-(4-methoxyphenyl)-4-oxo-4H-1-benzopyran-8-yl ester

Common Name

English

Code System Code Type Description

PUBCHEM

5384810

Created by admin on Sat Dec 16 12:26:45 GMT 2023 , Edited by admin on Sat Dec 16 12:26:45 GMT 2023

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FDA UNII

JMA5THP22N

Created by admin on Sat Dec 16 12:26:45 GMT 2023 , Edited by admin on Sat Dec 16 12:26:45 GMT 2023

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EPA CompTox

DTXSID30219365

Created by admin on Sat Dec 16 12:26:45 GMT 2023 , Edited by admin on Sat Dec 16 12:26:45 GMT 2023

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ECHA (EC/EINECS)

273-964-5

Created by admin on Sat Dec 16 12:26:45 GMT 2023 , Edited by admin on Sat Dec 16 12:26:45 GMT 2023

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CAS

69306-85-0

Created by admin on Sat Dec 16 12:26:45 GMT 2023 , Edited by admin on Sat Dec 16 12:26:45 GMT 2023

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NSC

363989

Created by admin on Sat Dec 16 12:26:45 GMT 2023 , Edited by admin on Sat Dec 16 12:26:45 GMT 2023

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