P-88-8991

Details

Stereochemistry	RACEMIC
Molecular Formula	C24H29FN2O4
Molecular Weight	428.4965
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=CC(=CC=C1OCCCN2CCC(CC2)C3=NOC4=CC(F)=CC=C34)C(C)O

InChI

InChIKey=SBKZGLWZGZQVHA-UHFFFAOYSA-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

HIDE SMILES / InChI

Molecular Formula	C24H29FN2O4
Molecular Weight	428.4965
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:12:35 UTC 2023` Edited by `admin` on `Sat Dec 16 11:12:35 UTC 2023`
Record UNII	ARO6P38EJS
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

P-88-8991

Common Name

English

BENZENEMETHANOL, 4-(3-(4-(6-FLUORO-1,2-BENZISOXAZOL-3-YL)-1-PIPERIDINYL)PROPOXY)-3-METHOXY-.ALPHA.-METHYL-

Systematic Name

English

P 88-8991

Code

English

P-88

Code

English

Code System Code Type Description

PUBCHEM

9823904

Created by admin on Sat Dec 16 11:12:35 UTC 2023 , Edited by admin on Sat Dec 16 11:12:35 UTC 2023

PRIMARY

CAS

133454-55-4

Created by admin on Sat Dec 16 11:12:35 UTC 2023 , Edited by admin on Sat Dec 16 11:12:35 UTC 2023

PRIMARY

EPA CompTox

DTXSID10431361

Created by admin on Sat Dec 16 11:12:35 UTC 2023 , Edited by admin on Sat Dec 16 11:12:35 UTC 2023

PRIMARY

FDA UNII

ARO6P38EJS

Created by admin on Sat Dec 16 11:12:35 UTC 2023 , Edited by admin on Sat Dec 16 11:12:35 UTC 2023

PRIMARY

Related Record Type Details


					VPO7KJ050N

ILOPERIDONE

PARENT -> METABOLITE ACTIVE

Comments:

The active metabolite P88 accounts for 19.5% and 34.0% of total plasma exposure in EM and PM, respectively.

Interaction Type:

MAJOR

Qualification:

PLASMA; URINE