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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H32O11
Molecular Weight 448.4615
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RO-61-0593 GLUCURONIDE

SMILES

[H][C@@]2(O[C@H](C[C@@H]1CCC(=O)O1)[C@H](CCCCCC)C(O)=O)O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O

InChI

InChIKey=BFPPURMTFRQYEH-ZQPHKLCWSA-N
InChI=1S/C20H32O11/c1-2-3-4-5-6-11(18(25)26)12(9-10-7-8-13(21)29-10)30-20-16(24)14(22)15(23)17(31-20)19(27)28/h10-12,14-17,20,22-24H,2-9H2,1H3,(H,25,26)(H,27,28)/t10-,11-,12+,14-,15-,16+,17-,20+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
RO-61-0593 GLUCURONIDE
Common Name English
ORLISTAT (M13-GA)
Common Name English
(2S,3S,4S,5R,6R)-6-(((2R,3S)-3-CARBOXY-1-((S)-5-OXOTETRAHYDROFURAN-2-YL)NONAN-2-YL)OXY)-3,4,5-TRIHYDROXYTETRAHYDRO-2H-PYRAN-2-CARBOXYLIC ACID
Systematic Name English
Code System Code Type Description
PUBCHEM
156613942
Created by admin on Sat Dec 16 09:33:59 GMT 2023 , Edited by admin on Sat Dec 16 09:33:59 GMT 2023
PRIMARY
FDA UNII
R7MY3BQ2K8
Created by admin on Sat Dec 16 09:33:59 GMT 2023 , Edited by admin on Sat Dec 16 09:33:59 GMT 2023
PRIMARY