1H-PYRIDO(3',4':4,5)PYRROLO(1,2,3-DE)QUINOXALINE-8(7H)-BUTANOL, .ALPHA.-(4-FLUOROPHENYL)-2,3,6B,9,10,10A-HEXAHYDRO-, (6BR,10AS)-

Details

Stereochemistry	EPIMERIC
Molecular Formula	C23H28FN3O
Molecular Weight	381.4863
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1H-PYRIDO(3',4':4,5)PYRROLO(1,2,3-DE)QUINOXALINE-8(7H)-BUTANOL, .ALPHA.-(4-FLUOROPHENYL)-2,3,6B,9,10,10A-HEXAHYDRO-, (6BR,10AS)-

Structure Search

SMILES

[H][C@]12CCN(CCCC(O)C3=CC=C(F)C=C3)C[C@@]1([H])C4=CC=CC5=C4N2CCN5

InChI

InChIKey=NUJKRFFWQXVMAM-QUCQDJGISA-N

InChI=1S/C23H28FN3O/c24-17-8-6-16(7-9-17)22(28)5-2-12-26-13-10-21-19(15-26)18-3-1-4-20-23(18)27(21)14-11-25-20/h1,3-4,6-9,19,21-22,25,28H,2,5,10-15H2/t19-,21-,22?/m0/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

1H-PYRIDO(3',4':4,5)PYRROLO(1,2,3-DE)QUINOXALINE-8(7H)-BUTANOL, .ALPHA.-(4-FLUOROPHENYL)-2,3,6B,9,10,10A-HEXAHYDRO-, (6BR,10AS)-

Systematic Name

English

LUMATEPERONE METABOLITE M565

Common Name

English

IC200565

Common Name

English

Code System Code Type Description

CAS

1469777-40-9

Created by admin on Sat Dec 16 15:40:11 GMT 2023 , Edited by admin on Sat Dec 16 15:40:11 GMT 2023

PRIMARY

PUBCHEM

68231912

Created by admin on Sat Dec 16 15:40:11 GMT 2023 , Edited by admin on Sat Dec 16 15:40:11 GMT 2023

PRIMARY

FDA UNII

KDT972M5ZY

Created by admin on Sat Dec 16 15:40:11 GMT 2023 , Edited by admin on Sat Dec 16 15:40:11 GMT 2023

PRIMARY

PARENT (METABOLITE)


					70BSQ12069

LUMATEPERONE

SUBSTANCE RECORD


					KDT972M5ZY

1H-PYRIDO(3',4':4,5)PYRROLO(1,2,3-DE)QUINOXALINE-8(7H)-BUTANOL, .ALPHA.-(4-FLUOROPHENYL)-2,3,6B,9,10,10A-HEXAHYDRO-, (6BR,10AS)-