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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H22O9
Molecular Weight 418.394
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ALOIN B

SMILES

OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)[C@H]2C3=CC(CO)=CC(O)=C3C(=O)C4=C2C=CC=C4O

InChI

InChIKey=AFHJQYHRLPMKHU-WEZNYRQKSA-N
InChI=1S/C21H22O9/c22-6-8-4-10-14(21-20(29)19(28)17(26)13(7-23)30-21)9-2-1-3-11(24)15(9)18(27)16(10)12(25)5-8/h1-5,13-14,17,19-26,28-29H,6-7H2/t13-,14-,17-,19+,20-,21+/m1/s1

HIDE SMILES / InChI

Description

Aloin is a physiologically active anthraquinone present in aloe. It is a mixture of two diastereomers, termed aloin A (also called barbaloin) and aloin B (or isobarbaloin) which have similar chemical properties. Aloin B is used for research purposes and is not intended for diagnostic or therapeutic use.

Approval Year

Conditions

ConditionModalityTargetsHighest PhaseProduct

Sample Use Guides

In Vivo Use Guide
Unknown
Route of Administration: Unknown
In Vitro Use Guide
Unknown