Naringenin-4′-O-β-D-glucuronopyranoside

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H20O11
Molecular Weight	448.3769
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Naringenin-4′-O-β-D-glucuronopyranoside

Structure Search

SMILES

O[C@@H]1[C@@H](O)[C@H](OC2=CC=C(C=C2)[C@@H]3CC(=O)C4=C(O)C=C(O)C=C4O3)O[C@@H]([C@H]1O)C(O)=O

InChI

InChIKey=DFIUUCDSSKATFP-CGXGPNJMSA-N

InChI=1S/C21H20O11/c22-9-5-11(23)15-12(24)7-13(31-14(15)6-9)8-1-3-10(4-2-8)30-21-18(27)16(25)17(26)19(32-21)20(28)29/h1-6,13,16-19,21-23,25-27H,7H2,(H,28,29)/t13-,16-,17-,18+,19-,21+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C21H20O11
Molecular Weight	448.3769
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 15:31:26 GMT 2023` Edited by `admin` on `Sat Dec 16 15:31:26 GMT 2023`
Record UNII	8L93T88GXR
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Naringenin-4′-O-β-D-glucuronopyranoside

Common Name

English

β-D-Glucopyranosiduronic acid, 4-[(2S)-3,4-dihydro-5,7-dihydroxy-4-oxo-2H-1-benzopyran-2-yl]phenyl

Common Name

English

Naringenin-4′-O-glucuronide

Common Name

English

(2S,3S,4S,5R,6S)-6-{4-[(2S)-5,7-dihydroxy-4-oxo-3,4-dihydro-2H-1-benzopyran-2-yl]phenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid

Systematic Name

English

4-[(2S)-3,4-Dihydro-5,7-dihydroxy-4-oxo-2H-1-benzopyran-2-yl]phenyl β-D-glucopyranosiduronic acid

Common Name

English

β-D-Glucopyranosiduronic acid, 4-(3,4-dihydro-5,7-dihydroxy-4-oxo-2H-1-benzopyran-2-yl)phenyl, (S)-

Common Name

English

Code System Code Type Description

FDA UNII

8L93T88GXR

Created by admin on Sat Dec 16 15:31:26 GMT 2023 , Edited by admin on Sat Dec 16 15:31:26 GMT 2023

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EPA CompTox

DTXSID60858165

Created by admin on Sat Dec 16 15:31:26 GMT 2023 , Edited by admin on Sat Dec 16 15:31:26 GMT 2023

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PUBCHEM

52224404

Created by admin on Sat Dec 16 15:31:26 GMT 2023 , Edited by admin on Sat Dec 16 15:31:26 GMT 2023

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CAS

158196-35-1

Created by admin on Sat Dec 16 15:31:26 GMT 2023 , Edited by admin on Sat Dec 16 15:31:26 GMT 2023

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