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Compounds

COMPOUND NPA018611

STRUCTURE

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PROPERTIES

NPAID	NPA018611
CLUSTER ID	22
NODE ID	21
NAME	3,4-dihydro-8-hydroxy-6-methoxy-(3R)-propylisocoumarin
FORMULA	C13H16O4
MOLECULAR WEIGHT (Da)	236.2670
ACCURATE MASS (Da)	236.1049
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Unknown-fungus
ORIGIN SPECIES	sp. 120379
InChIKey	RYPQHAKCQSXFGH-SECBINFHSA-N
InChI	InChI=1S/C13H16O4/c1-3-4-9-5-8-6-10(16-2)7-11(14)12(8)13(15)17-9/h6-7,9,14H,3-5H2,1-2H3/t9-/m1/s1
SMILES	CCC[C@@H]1CC2=CC(=CC(=C2C(=O)O1)O)OC

ORIGINAL ISOLATION REFERENCE

CITATION	Sumarah, Mark W.; Puniani, Eva; Blackwell, Barbara A.; Miller, J. David Characterization of polyketide metabolites from foliar endophytes of Picea glauca Journal of Natural Products 2008 71 (8) 1393-1398.
DOI	10.1021/np800192f	PMID	18636777

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Genus	Unknown-fungus	MycoBank	-

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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