7-EPI-HYDROXY-MIDOSTAURIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C35H30N4O5
Molecular Weight	586.6365
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CO[C@@H]1[C@@H](C[C@H]2O[C@]1(C)n3c4ccccc4c5c6[C@H](O)NC(=O)c6c7c8ccccc8n2c7c35)N(C)C(=O)C9=CC=CC=C9

InChI

InChIKey=ZZSBPGIGIUFJRA-AKIDMACVSA-N

InChI=1S/C35H30N4O5/c1-35-31(43-3)23(37(2)34(42)18-11-5-4-6-12-18)17-24(44-35)38-21-15-9-7-13-19(21)25-27-28(33(41)36-32(27)40)26-20-14-8-10-16-22(20)39(35)30(26)29(25)38/h4-16,23-24,31,33,41H,17H2,1-3H3,(H,36,40)/t23-,24-,31-,33+,35+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C35H30N4O5
Molecular Weight	586.6365
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 12:54:28 GMT 2025` Edited by `admin` on `Wed Apr 02 12:54:28 GMT 2025`
Record UNII	BEF4G8P8SL
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

CGP-52421, (S)-

Preferred Name

English

7-EPI-HYDROXY-MIDOSTAURIN

Common Name

English

N-((5R,7R,8R,9S,14S)-14-HYDROXY-8-METHOXY-9-METHYL-16-OXO-6,7,8,9,15,16-HEXAHYDRO-5H,14H-17-OXA-4B,9A,15-TRIAZA-5,9-METHANODIBENZO(B,H)CYCLONONA(JKL)CYCLOPENTA(E)-AS-INDACEN-7-YL)-N-METHYLBENZAMIDE

Systematic Name

English

BENZAMIDE, N-((3S,9S,10R,11R,13R)-2,3,10,11,12,13-HEXAHYDRO-3-HYDROXY-10-METHOXY-9-METHYL-1-OXO-9,13-EPOXY-1H,9H-DIINDOLO(1,2,3-GH:3',2',1'-LM)PYRROLO(3,4-J)(1,7)BENZODIAZONIN-11-YL)-N-METHYL-

Systematic Name

English

(S)-3-HYDROXY MIDOSTAURIN

Common Name

English

N-((3S,9S,10R,11R,13R)-2,3,10,11,12,13-HEXAHYDRO-3-HYDROXY-10-METHOXY-9-METHYL-1-OXO-9,13-EPOXY-1H,9H-DIINDOLO(1,2,3-GH:3',2',1'-LM)PYRROLO(3,4-J)(1,7)BENZODIAZONIN-11-YL)-N-METHYLBENZAMIDE

Systematic Name

English

Code System Code Type Description

PUBCHEM

52945601

Created by admin on Wed Apr 02 12:54:28 GMT 2025 , Edited by admin on Wed Apr 02 12:54:28 GMT 2025

PRIMARY

CAS

945260-14-0

Created by admin on Wed Apr 02 12:54:28 GMT 2025 , Edited by admin on Wed Apr 02 12:54:28 GMT 2025

PRIMARY

FDA UNII

BEF4G8P8SL

Created by admin on Wed Apr 02 12:54:28 GMT 2025 , Edited by admin on Wed Apr 02 12:54:28 GMT 2025

PRIMARY