2-HYDROXY-6-METHOXY-3-METHYLACETOPHENONE-4-O-.BETA.-GLUCURONIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C16H20O10
Molecular Weight	372.324
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-HYDROXY-6-METHOXY-3-METHYLACETOPHENONE-4-O-.BETA.-GLUCURONIDE

Structure Search

SMILES

COC1=C(C(C)=O)C(O)=C(C)C(O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)=C1

InChI

InChIKey=YWKJNMCFKRUTQY-JHZZJYKESA-N

InChI=1S/C16H20O10/c1-5-7(4-8(24-3)9(6(2)17)10(5)18)25-16-13(21)11(19)12(20)14(26-16)15(22)23/h4,11-14,16,18-21H,1-3H3,(H,22,23)/t11-,12-,13+,14-,16+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C16H20O10
Molecular Weight	372.324
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 16:14:00 GMT 2023` Edited by `admin` on `Sat Dec 16 16:14:00 GMT 2023`
Record UNII	7OL47ZIK1T
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-HYDROXY-6-METHOXY-3-METHYLACETOPHENONE-4-O-.BETA.-GLUCURONIDE

Common Name

English

.BETA.-D-GLUCOPYRANOSIDURONIC ACID, 4-ACETYL-3-HYDROXY-5-METHOXY-2-METHYLPHENYL

Systematic Name

English

Code System Code Type Description

PUBCHEM

154572853

Created by admin on Sat Dec 16 16:14:00 GMT 2023 , Edited by admin on Sat Dec 16 16:14:00 GMT 2023

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CAS

1314746-35-4

Created by admin on Sat Dec 16 16:14:00 GMT 2023 , Edited by admin on Sat Dec 16 16:14:00 GMT 2023

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FDA UNII

7OL47ZIK1T

Created by admin on Sat Dec 16 16:14:00 GMT 2023 , Edited by admin on Sat Dec 16 16:14:00 GMT 2023

PRIMARY

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