SOTRASTAURIN

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C25H22N6O2
Molecular Weight	438.4812
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of SOTRASTAURIN

Structure Search

SMILES

CN1CCN(CC1)C2=NC(C3=C(C(=O)NC3=O)C4=CNC5=C4C=CC=C5)=C6C=CC=CC6=N2

InChI

InChIKey=OAVGBZOFDPFGPJ-UHFFFAOYSA-N

InChI=1S/C25H22N6O2/c1-30-10-12-31(13-11-30)25-27-19-9-5-3-7-16(19)22(28-25)21-20(23(32)29-24(21)33)17-14-26-18-8-4-2-6-15(17)18/h2-9,14,26H,10-13H2,1H3,(H,29,32,33)

HIDE SMILES / InChI

Molecular Formula	C25H22N6O2
Molecular Weight	438.4812
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 `Fri Dec 15 16:38:06 UTC 2023` Edited by `admin` on `Fri Dec 15 16:38:06 UTC 2023`
Record UNII	7I279E1NZ8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SOTRASTAURIN

Official Name

English

Sotrastaurin [WHO-DD]

Common Name

English

sotrastaurin [INN]

Common Name

English

AEB-071

Code

English

3-(1H-Indol-3-yl)-4-[2-(4-methylpiperazin-1-yl)quinazolin-4-yl]-1H-pyrrole-2,5-dione

Systematic Name

English

1H-PYRROLE-2,5-DIONE, 3-(1H-INDOL-3-YL)-4-(2-(4-METHYL-1-PIPERAZINYL)-4-QUINAZOLINYL)-

Systematic Name

English

SOTRASTAURIN [USAN]

Common Name

English

AEB071

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C2089

Created by admin on Fri Dec 15 16:38:06 UTC 2023 , Edited by admin on Fri Dec 15 16:38:06 UTC 2023

Code System Code Type Description

ChEMBL

CHEMBL565612

Created by admin on Fri Dec 15 16:38:06 UTC 2023 , Edited by admin on Fri Dec 15 16:38:06 UTC 2023

PRIMARY

FDA UNII

7I279E1NZ8

Created by admin on Fri Dec 15 16:38:06 UTC 2023 , Edited by admin on Fri Dec 15 16:38:06 UTC 2023

PRIMARY

EVMPD

SUB124612

Created by admin on Fri Dec 15 16:38:06 UTC 2023 , Edited by admin on Fri Dec 15 16:38:06 UTC 2023

PRIMARY

USAN

WW-26

Created by admin on Fri Dec 15 16:38:06 UTC 2023 , Edited by admin on Fri Dec 15 16:38:06 UTC 2023

PRIMARY

SMS_ID

100000145826

Created by admin on Fri Dec 15 16:38:06 UTC 2023 , Edited by admin on Fri Dec 15 16:38:06 UTC 2023

PRIMARY

MESH

C543528

Created by admin on Fri Dec 15 16:38:06 UTC 2023 , Edited by admin on Fri Dec 15 16:38:06 UTC 2023

PRIMARY

INN

8893

Created by admin on Fri Dec 15 16:38:06 UTC 2023 , Edited by admin on Fri Dec 15 16:38:06 UTC 2023

PRIMARY

NCI_THESAURUS

C80630

Created by admin on Fri Dec 15 16:38:06 UTC 2023 , Edited by admin on Fri Dec 15 16:38:06 UTC 2023

PRIMARY

PUBCHEM

10296883

Created by admin on Fri Dec 15 16:38:06 UTC 2023 , Edited by admin on Fri Dec 15 16:38:06 UTC 2023

PRIMARY

CAS

425637-18-9

Created by admin on Fri Dec 15 16:38:06 UTC 2023 , Edited by admin on Fri Dec 15 16:38:06 UTC 2023

PRIMARY

DRUG BANK

DB12369

Created by admin on Fri Dec 15 16:38:06 UTC 2023 , Edited by admin on Fri Dec 15 16:38:06 UTC 2023

PRIMARY

CHEBI

90531

Created by admin on Fri Dec 15 16:38:06 UTC 2023 , Edited by admin on Fri Dec 15 16:38:06 UTC 2023

PRIMARY

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PROTEIN KINASE C ALPHA TYPE

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ACTIVE MOIETY

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