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Compounds

COMPOUND NPA002168

STRUCTURE

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PROPERTIES

NPAID	NPA002168
CLUSTER ID	792
NODE ID	687
NAME	Mycophenolic acid ethyl ester
FORMULA	C19H24O6
MOLECULAR WEIGHT (Da)	348.3950
ACCURATE MASS (Da)	348.1573
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Penicillium
ORIGIN SPECIES	brevicompactum
InChIKey	CUWYKVMNNGRAOW-IZZDOVSWSA-N
InChI	InChI=1S/C19H24O6/c1-5-24-15(20)9-7-11(2)6-8-13-17(21)16-14(10-25-19(16)22)12(3)18(13)23-4/h6,21H,5,7-10H2,1-4H3/b11-6+
SMILES	CCOC(=O)CC/C(=C/CC1=C(C2=C(COC2=O)C(=C1OC)C)O)/C

ORIGINAL ISOLATION REFERENCE

CITATION	Campbell, I.M.; Calzadilla, C.H.; McCorkindale, N.J. Some new metabolites related to mycophenolic acid Tetrahedron Letters 1966 7 (42) 5107-5111.
DOI	10.1016/s0040-4039(01)89288-1	PMID	-

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Eurotiomycetes	MycoBank	147545
Order	Eurotiales	MycoBank	5042
Family	Aspergillaceae	MycoBank	1131492
Genus	Penicillium	MycoBank	5073

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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