3-GALLOYLSHIKIMIC ACID

O[C@@H]1CC(=C[C@@H](OC(=O)C2=CC(O)=C(O)C(O)=C2)[C@H]1O)C(O)=O

InChIKey=CFCRCJAHPCJZLP-FOGDFJRCSA-N

InChI=1S/C14H14O9/c15-7-2-6(3-8(16)11(7)18)14(22)23-10-4-5(13(20)21)1-9(17)12(10)19/h2-4,9-10,12,15-19H,1H2,(H,20,21)/t9-,10-,12+/m1/s1

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:58:00 GMT 2025` Edited by `admin` on `Mon Mar 31 22:58:00 GMT 2025`
Record UNII	0Q46TTD0BA
Record Status	`Validated (UNII)`
Record Version

Name

Type

Language

3-O-GALLOYLSHIKIMIC ACID

Preferred Name

English

3-GALLOYLSHIKIMIC ACID

Common Name

English

BENZOIC ACID, 3,4,5-TRIHYDROXY-, (1R,5R,6S)-3-CARBOXY-5,6-DIHYDROXY-2-CYCLOHEXEN-1-YL ESTER

Common Name

English

Code System Code Type Description

PUBCHEM

10449030

Created by admin on Mon Mar 31 22:58:00 GMT 2025 , Edited by admin on Mon Mar 31 22:58:00 GMT 2025

PRIMARY

CAS

110082-91-2

Created by admin on Mon Mar 31 22:58:00 GMT 2025 , Edited by admin on Mon Mar 31 22:58:00 GMT 2025

PRIMARY

FDA UNII

0Q46TTD0BA

Created by admin on Mon Mar 31 22:58:00 GMT 2025 , Edited by admin on Mon Mar 31 22:58:00 GMT 2025

PRIMARY