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Compounds

COMPOUND NPA009686

STRUCTURE

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PROPERTIES

NPAID	NPA009686
CLUSTER ID	2450
NODE ID	443
NAME	Monascin
FORMULA	C21H26O5
MOLECULAR WEIGHT (Da)	358.4340
ACCURATE MASS (Da)	358.1780
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Monascus
ORIGIN SPECIES	sp.
InChIKey	XXKNHBAFFJINCK-RVEJDSBJSA-N
InChI	InChI=1S/C21H26O5/c1-4-6-7-9-17(22)18-16-11-13-10-14(8-5-2)25-12-15(13)19(23)21(16,3)26-20(18)24/h5,8,10,16,18H,4,6-7,9,11-12H2,1-3H3/b8-5+/t16-,18+,21-/m1/s1
SMILES	CCCCCC(=O)[C@@H]1[C@H]2CC3=C(COC(=C3)/C=C/C)C(=O)[C@@]2(OC1=O)C

ORIGINAL ISOLATION REFERENCE

CITATION	Fielding, BC; Holker, JSE; Jones, DF; Powell, ADG; Richmond, KW; Robertson, Alexander; Whalley, WB 898. The chemistry of fungi. Part XXXIX. The structure of monascin Journal of the Chemical Society 1961 4579-4589.
DOI	10.1039/jr9610004579	PMID	-

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Eurotiomycetes	MycoBank	147545
Family	Monascaceae	MycoBank	-
Genus	Monascus	MycoBank	5097

CLASSYFIRE

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DESCRIPTION	[[ getValue('description') ]]
KINGDOM	[[ getValue('kingdom') ]]
SUPER CLASS	[[ getValue('superclass') ]]
CLASS	[[ getValue('class') ]]
SUB CLASS	[[ getValue('subclass') ]]
MOLECULAR FRAMEWORK	[[ getValue('molecular_framework') ]]

NP CLASSIFIER

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SUPER CLASS	[[ getValue('superclass_results') ]]
CLASS	[[ getValue('class_results') ]]
PATHWAY	[[ getValue('pathway_results') ]]
IS GLYCOSIDE?	[[ getValue('isglycoside') ]]

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