7-HYDROXYQUETIAPINE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H25N3O3S
Molecular Weight	399.507
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OCCOCCN1CCN(CC1)C2=NC3=C(SC4=CC=CC=C24)C=C(O)C=C3

InChI

InChIKey=VEGVCHRFYPFJFO-UHFFFAOYSA-N

InChI=1S/C21H25N3O3S/c25-12-14-27-13-11-23-7-9-24(10-8-23)21-17-3-1-2-4-19(17)28-20-15-16(26)5-6-18(20)22-21/h1-6,15,25-26H,7-14H2

HIDE SMILES / InChI

Molecular Formula	C21H25N3O3S
Molecular Weight	399.507
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:00:11 UTC 2023` Edited by `admin` on `Sat Dec 16 09:00:11 UTC 2023`
Record UNII	LO2PHD1746
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

7-HYDROXYQUETIAPINE

Common Name

English

DIBENZO(B,F)(1,4)THIAZEPIN-7-OL, 11-(4-(2-(2-HYDROXYETHOXY)ETHYL)-1-PIPERAZINYL)-

Systematic Name

English

ICI-214227

Code

English

Code System Code Type Description

CAS

139079-39-3

Created by admin on Sat Dec 16 09:00:11 UTC 2023 , Edited by admin on Sat Dec 16 09:00:11 UTC 2023

PRIMARY

PUBCHEM

132203

Created by admin on Sat Dec 16 09:00:11 UTC 2023 , Edited by admin on Sat Dec 16 09:00:11 UTC 2023

PRIMARY

EPA CompTox

DTXSID10160886

Created by admin on Sat Dec 16 09:00:11 UTC 2023 , Edited by admin on Sat Dec 16 09:00:11 UTC 2023

PRIMARY

FDA UNII

LO2PHD1746

Created by admin on Sat Dec 16 09:00:11 UTC 2023 , Edited by admin on Sat Dec 16 09:00:11 UTC 2023

PRIMARY

Related Record Type Details


					BGL0JSY5SI

QUETIAPINE

PARENT -> METABOLITE ACTIVE

Comments:

relatively low concentrations in blood

Amount: