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Compounds

COMPOUND NPA002679

STRUCTURE

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PROPERTIES

NPAID	NPA002679
CLUSTER ID	1574
NODE ID	1291
NAME	Monacolin O
FORMULA	C25H40O8
MOLECULAR WEIGHT (Da)	468.5870
ACCURATE MASS (Da)	468.2723
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Monascus
ORIGIN SPECIES	purpureus
InChIKey	YGYWCCFAWCDWKW-HGRHQEBXSA-N
InChI	InChI=1S/C25H40O8/c1-6-13(2)25(31)33-21-9-14(3)24(30)19-12-20(28)15(4)18(23(19)21)8-7-16(26)10-17(27)11-22(29)32-5/h12-18,21,23-24,26-27,30H,6-11H2,1-5H3/t13?,14-,15-,16+,17+,18+,21+,23-,24-/m1/s1
SMILES	CCC(C)C(=O)O[C@H]1C[C@H]([C@H](C2=CC(=O)[C@@H]([C@@H]([C@@H]12)CC[C@@H](C[C@@H](CC(=O)OC)O)O)C)O)C

ORIGINAL ISOLATION REFERENCE

CITATION	Liu, Ming-Tao; Wang, A-Li; Sun, Zhen; Li, Jin-Jie; Wu, Xiu-Li; Liu, Yan-Xia; Shang, Xiao-Ya Cytotoxic monacolin analogs from Monascus purpureus -fermented rice Journal of Asian Natural Products Research 2013 15 (6) 600-609.
DOI	10.1080/10286020.2013.790379	PMID	23659665

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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