HALOFUGINONE HYDROBROMIDE, (-)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C16H17BrClN3O3.BrH
Molecular Weight	495.593
Optical Activity	( - )
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of HALOFUGINONE HYDROBROMIDE, (-)-

Structure Search

SMILES

Br.O[C@@H]1CCCN[C@H]1CC(=O)CN2C=NC3=C(C=C(Cl)C(Br)=C3)C2=O

InChI

InChIKey=SJUWEPZBTXEUMU-LDXVYITESA-N

InChI=1S/C16H17BrClN3O3.BrH/c17-11-6-13-10(5-12(11)18)16(24)21(8-20-13)7-9(22)4-14-15(23)2-1-3-19-14;/h5-6,8,14-15,19,23H,1-4,7H2;1H/t14-,15+;/m0./s1

HIDE SMILES / InChI

Molecular Formula	BrH
Molecular Weight	80.912
Charge	0
Count

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

Molecular Formula	C16H17BrClN3O3
Molecular Weight	414.681
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 20:45:26 GMT 2025` Edited by `admin` on `Tue Apr 01 20:45:26 GMT 2025`
Record UNII	Q86XE47UJ3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CHLOROBROMOFEBRIFUGINE

Preferred Name

English

HALOFUGINONE HYDROBROMIDE, (-)-

Common Name

English

4(3H)-QUINAZOLINONE, 7-BROMO-6-CHLORO-3-(3-((2S,3R)-3-HYDROXY-2-PIPERIDINYL)-2-OXOPROPYL)-, HYDROBROMIDE (1:1)

Systematic Name

English

7-BROMO-6-CHLORO-3-(3-((2S,3R)-3-HYDROXY-2-PIPERIDYL)-2-OXO-PROPYL)QUINAZOLIN-4-ONE HYDROBROMIDE

Systematic Name

English

CEBEGINE

Common Name

English

4(3H)-QUINAZOLINONE, 7-BROMO-6-CHLORO-3-(3-(3-HYDROXY-2-PIPERIDINYL)-2-OXOPROPYL)-, MONOHYDROBROMIDE, (2S-TRANS)-

Systematic Name

English

CHLORO-BROMOFEBRIFUGINE

Common Name

English

Code System Code Type Description

CAS

57426-42-3

Created by admin on Tue Apr 01 20:45:26 GMT 2025 , Edited by admin on Tue Apr 01 20:45:26 GMT 2025

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FDA UNII

Q86XE47UJ3

Created by admin on Tue Apr 01 20:45:26 GMT 2025 , Edited by admin on Tue Apr 01 20:45:26 GMT 2025

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EPA CompTox

DTXSID601339438

Created by admin on Tue Apr 01 20:45:26 GMT 2025 , Edited by admin on Tue Apr 01 20:45:26 GMT 2025

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PUBCHEM

400771

Created by admin on Tue Apr 01 20:45:26 GMT 2025 , Edited by admin on Tue Apr 01 20:45:26 GMT 2025

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