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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H29FN2O4
Molecular Weight 428.4974
Optical Activity ( - )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of P-88-8991, (-)-

SMILES

C[C@@]([H])(c1ccc(c(c1)OC)OCCCN2CCC(CC2)c3c4ccc(cc4on3)F)O

InChI

InChIKey=SBKZGLWZGZQVHA-INIZCTEOSA-N
InChI=1S/C24H29FN2O4/c1-16(28)18-4-7-21(23(14-18)29-2)30-13-3-10-27-11-8-17(9-12-27)24-20-6-5-19(25)15-22(20)31-26-24/h4-7,14-17,28H,3,8-13H2,1-2H3/t16-/m0/s1

HIDE SMILES / InChI

Molecular Formula C24H29FN2O4
Molecular Weight 428.4974
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

P-88-8991, (-)- is a metabolite of Iloperidone. It has functional affinity for noradrenergic, dopaminergic and serotoninergic receptors. Humans produce only one enantiomer stereospecifically following administration of Iloperidone. Preclinical studies revealed that P-88-8991, (-)- might be useful for the treatment of psychotic disorders such as schizophrenia and bipolar disorders.

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
8.9 null [pKi]
7.8 null [pKi]
8.9 null [pKi]
8.1 null [pKi]
7.4 null [pKi]
Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
Primary
Unknown

Approved Use

Unknown

Sample Use Guides

In Vivo Use Guide
Curator's Comment:: Human: 1 to about 300 mg/kg in divided doses up to four times a day
Rat: 0.01 to about 10 mg/kg
Route of Administration: Other
In Vitro Use Guide
Unknown
Substance Class Chemical
Created
by admin
on Sat Jun 26 03:38:44 UTC 2021
Edited
by admin
on Sat Jun 26 03:38:44 UTC 2021
Record UNII
7SV1ZOG031
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
P-88-8991, (-)-
Code English
(.ALPHA.S)-4-(3-(4-(6-FLUORO-1,2-BENZISOXAZOL-3-YL)-1-PIPERIDINYL)PROPOXY)-3-METHOXY-.ALPHA.-METHYLBENZENEMETHANOL
Common Name English
BENZENEMETHANOL, 4-(3-(4-(6-FLUORO-1,2-BENZISOXAZOL-3-YL)-1-PIPERIDINYL)PROPOXY)-3-METHOXY-.ALPHA.-METHYL-, (.ALPHA.S)-
Systematic Name English
Code System Code Type Description
FDA UNII
7SV1ZOG031
Created by admin on Sat Jun 26 03:38:44 UTC 2021 , Edited by admin on Sat Jun 26 03:38:44 UTC 2021
PRIMARY
PUBCHEM
10365268
Created by admin on Sat Jun 26 03:38:44 UTC 2021 , Edited by admin on Sat Jun 26 03:38:44 UTC 2021
PRIMARY
CAS
501373-88-2
Created by admin on Sat Jun 26 03:38:44 UTC 2021 , Edited by admin on Sat Jun 26 03:38:44 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
Related Record Type Details
ACTIVE MOIETY