ROSMARINYL GLUCOSIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H26O13
Molecular Weight	522.4554
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC[C@H]1O[C@@H](OC2=CC=C(C[C@@H](OC(=O)\C=C\C3=CC=C(O)C(O)=C3)C(O)=O)C=C2O)[C@H](O)[C@@H](O)[C@@H]1O

InChI

InChIKey=GBPUVZAXOLYUDN-PRFRQLEPSA-N

InChI=1S/C24H26O13/c25-10-18-20(30)21(31)22(32)24(37-18)36-16-5-2-12(8-15(16)28)9-17(23(33)34)35-19(29)6-3-11-1-4-13(26)14(27)7-11/h1-8,17-18,20-22,24-28,30-32H,9-10H2,(H,33,34)/b6-3+/t17-,18-,20-,21+,22-,24-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C24H26O13
Molecular Weight	522.4554
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:00:33 GMT 2025` Edited by `admin` on `Mon Mar 31 21:00:33 GMT 2025`
Record UNII	3LBK307OWD
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ROSMARINYL GLUCOSIDE

Official Name

English

4-O-.BETA.-D-GLUCOPYRANOSYLROSMARINIC ACID

Preferred Name

English

INOVEOL ROSMARINIC ACID-GLUCOSIDE

Common Name

English

BENZENEPROPANOIC ACID, .ALPHA.-(((2E)-3-(3,4-DIHYDROXYPHENYL)-1-OXO-2-PROPENYL)OXY)-4-(.BETA.-D-GLUCOPYRANOSYLOXY)-3-HYDROXY-, (.ALPHA.R)-

Common Name

English

ROSMARINIC ACID 4-O-.BETA.-D-GLUCOSIDE

Common Name

English

BENZENEPROPANOIC ACID, .ALPHA.-(((2E)-3-(3,4-DIHYDROXYPHENYL)-1-OXO-2-PROPEN-1-YL)OXY)-4-(.BETA.-D-GLUCOPYRANOSYLOXY)-3-HYDROXY-, (.ALPHA.R)-

Common Name

English

Code System Code Type Description

PUBCHEM

11606086