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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H23NO5
Molecular Weight 321.3682
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (1R,2R)-2-(((3AR,4R,7S,7AS,8S)-8-HYDROXY-1,3-DIOXOOCTAHYDRO-2H-4,7-METHANOISOINDOL-2-YL)METHYL)CYCLOHEXANE-1-CARBOXYLIC ACID

SMILES

[H][C@@]12[C@H]3CC[C@H]([C@@H]3O)[C@]1([H])C(=O)N(C[C@@H]4CCCC[C@H]4C(O)=O)C2=O

InChI

InChIKey=BEXKKQJRYXLGSL-QDEYISRKSA-N
InChI=1S/C17H23NO5/c19-14-10-5-6-11(14)13-12(10)15(20)18(16(13)21)7-8-3-1-2-4-9(8)17(22)23/h8-14,19H,1-7H2,(H,22,23)/t8-,9+,10-,11+,12-,13+,14-/m0/s1

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
(1R,2R)-2-(((3AR,4R,7S,7AS,8S)-8-HYDROXY-1,3-DIOXOOCTAHYDRO-2H-4,7-METHANOISOINDOL-2-YL)METHYL)CYCLOHEXANE-1-CARBOXYLIC ACID
Systematic Name English
LURASIDONE METABOLITE M6
Common Name English
Code System Code Type Description
CAS
1796569-34-0
Created by admin on Sat Dec 16 15:04:15 GMT 2023 , Edited by admin on Sat Dec 16 15:04:15 GMT 2023
PRIMARY
FDA UNII
6UZ3937LJP
Created by admin on Sat Dec 16 15:04:15 GMT 2023 , Edited by admin on Sat Dec 16 15:04:15 GMT 2023
PRIMARY
PARENT (METABOLITE)
Structure of LURASIDONE
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