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Details

Stereochemistry EPIMERIC
Molecular Formula C29H35NO9
Molecular Weight 541.5895
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-O-DESMETHYLDONEPEZIL GLUCURONIDE

SMILES

COC1=C(O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)C=C3C(=O)C(CC4CCN(CC5=CC=CC=C5)CC4)CC3=C1

InChI

InChIKey=GUJDLRRGLWFUSI-XDBQMMMZSA-N
InChI=1S/C29H35NO9/c1-37-21-13-18-12-19(11-16-7-9-30(10-8-16)15-17-5-3-2-4-6-17)23(31)20(18)14-22(21)38-29-26(34)24(32)25(33)27(39-29)28(35)36/h2-6,13-14,16,19,24-27,29,32-34H,7-12,15H2,1H3,(H,35,36)/t19?,24-,25-,26+,27-,29+/m0/s1

HIDE SMILES / InChI

Molecular Formula C29H35NO9
Molecular Weight 541.5895
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 5 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:18:48 GMT 2025
Edited
by admin
on Mon Mar 31 22:18:48 GMT 2025
Record UNII
1O435436YC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-O-DESMETHYLDONEPEZIL GLUCURONIDE
Common Name English
6-O-DESMETHYL DONEPEZIL .BETA.-D-GLUCURONIDE
Preferred Name English
.BETA.-D-GLUCOPYRANOSIDURONIC ACID, 2,3-DIHYDRO-6-METHOXY-3-OXO-2-((1-(PHENYLMETHYL)-4-PIPERIDINYL)METHYL)-1H-INDEN-5-YL
Systematic Name English
DONEPEZIL (METABOLITE 11 GLUCURONIDE)
Common Name English
Code System Code Type Description
FDA UNII
1O435436YC
Created by admin on Mon Mar 31 22:18:48 GMT 2025 , Edited by admin on Mon Mar 31 22:18:48 GMT 2025
PRIMARY
CAS
220170-73-0
Created by admin on Mon Mar 31 22:18:48 GMT 2025 , Edited by admin on Mon Mar 31 22:18:48 GMT 2025
PRIMARY
EPA CompTox
DTXSID60747560
Created by admin on Mon Mar 31 22:18:48 GMT 2025 , Edited by admin on Mon Mar 31 22:18:48 GMT 2025
PRIMARY
PUBCHEM
71315758
Created by admin on Mon Mar 31 22:18:48 GMT 2025 , Edited by admin on Mon Mar 31 22:18:48 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> METABOLITE