7-Hydroxy Quetiapine (1.0 mg/mL in Methanol)

Analyte Name

7-Hydroxyquetiapine

CAS Number

139079-39-3

Molecular Formula

C21 H25 N3 O3 S

Molecular Weight

399.51

Measured Value

1.0 mg/mL

Accurate Mass

399.1617

SMILES

OCCOCCN1CCN(CC1)C2=Nc3ccc(O)cc3Sc4ccccc24

InChI

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

IUPAC

6-[4-[2-(2-hydroxyethoxy)ethyl]piperazin-1-yl]benzo[b][1,4]benzothiazepin-2-ol

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Single Solution

Matrix

Methanol