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Compounds

COMPOUND NPA006054

STRUCTURE

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PROPERTIES

NPAID	NPA006054
CLUSTER ID	2167
NODE ID	1732
NAME	1-(4-Ethylphenyl)-1,2-ethanediol
FORMULA	C10H14O2
MOLECULAR WEIGHT (Da)	166.2200
ACCURATE MASS (Da)	166.0994
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Boletus
ORIGIN SPECIES	edulis
InChIKey	RYGSTNQAZVYULU-UHFFFAOYSA-N
InChI	InChI=1S/C10H14O2/c1-2-8-3-5-9(6-4-8)10(12)7-11/h3-6,10-12H,2,7H2,1H3
SMILES	CCC1=CC=C(C=C1)C(CO)O

ORIGINAL ISOLATION REFERENCE

CITATION	Yang, Wan-Qiu; Qin, Xiang-Dong; Shao, Hong-Jun; Fang, Li-Zhen; Wang, Fei; Ding, Zhi-Hui; Dong, Ze-Jun; Liu, Ji-Kai New phenyl-ethanediols from the culture broth of Boletus edulis Journal of Basic Microbiology 2007 47 (2) 191-193.
DOI	10.1002/jobm.200610260	PMID	17440922

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Basidiomycota	MycoBank	5204
Class	Agaricomycetes	MycoBank	155619
Order	Boletales	MycoBank	68889
Family	Boletaceae	MycoBank	5368
Genus	Boletus	MycoBank	5369

CLASSYFIRE

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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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