NEOQUASSIN

Details

Stereochemistry	EPIMERIC
Molecular Formula	C22H30O6
Molecular Weight	390.47
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12C[C@@]3([H])[C@H](C)C=C(OC)C(=O)[C@]3(C)[C@@]4([H])C(=O)C(OC)=C(C)[C@]([H])(CC(O)O1)[C@]24C

InChI

InChIKey=BDQNCUODBJZKIY-NUPPOKJBSA-N

InChI=1S/C22H30O6/c1-10-7-14(26-5)20(25)22(4)12(10)8-15-21(3)13(9-16(23)28-15)11(2)18(27-6)17(24)19(21)22/h7,10,12-13,15-16,19,23H,8-9H2,1-6H3/t10-,12+,13+,15-,16?,19+,21-,22+/m1/s1

HIDE SMILES / InChI

Approval Year

PubMed

Title	Date	PubMed
Anti-tuberculosis activity of quassinoids.	1997 Sep	9332005
[Analysis of constituents in Jamaica quassia extract, a natural bittering agent].	2003 Dec	15038116
Inhibition of CYP1A1 by Quassinoids found in Picrasma excelsa.	2009 Feb	19016402
Quassinoid constituents of Quassia amara L. leaf herbal tea. Impact on its antimalarial activity and cytotoxicity.	2009 Oct 29	19665539
Plasmodium falciparum: in vitro interaction of quassin and neo-quassin with artesunate, a hemisuccinate derivative of artemisinin.	2010 Apr	20036657

Patents

Name

Type

Language

NEOQUASSIN

Common Name

English

SIMALIKAHEMIACETAL A

Common Name

English

NEOQUASSINE

Common Name

English

NSC-139168

Code

English

NIGAKIHEMIACETAL B

Common Name

English

NEOQUASSIN [MI]

Common Name

English

PICRASA-2,12-DIENE-1,11-DIONE, 16-HYDROXY-2,12-DIMETHOXY-

Common Name

English

Code System Code Type Description

CAS

76-77-7