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Compounds

COMPOUND NPA013343

STRUCTURE

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PROPERTIES

NPAID	NPA013343
CLUSTER ID	4900
NODE ID	3525
NAME	Pestaloporonin C
FORMULA	C16H24O4
MOLECULAR WEIGHT (Da)	280.3640
ACCURATE MASS (Da)	280.1675
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Pestalotiopsis
ORIGIN SPECIES	sp.
InChIKey	DQOGXWZWFMMBQR-KFWWJZLASA-N
InChI	InChI=1S/C16H24O4/c1-10(2)5-14-12(9-17)8-13(20-4)6-11(3)7-15(18)16(14)19/h6,8,13-15,17-18H,1,5,7,9H2,2-4H3/t13-,14-,15+/m1/s1
SMILES	C=C(C)C[C@H]1C(=O)[C@@H](O)CC(C)=C[C@@H](OC)C=C1CO

ORIGINAL ISOLATION REFERENCE

CITATION	Hwang, In Hyun; Swenson, Dale C.; Gloer, James B.; Wicklow, Donald T. Pestaloporonins: Caryophyllene-Derived Sesquiterpenoids from a Fungicolous Isolate of Pestalotiopsis sp Organic Letters 2015 17 (17) 4284-4287.
DOI	10.1021/acs.orglett.5b02080	PMID	26287562

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Sordariomycetes	MycoBank	147550
Order	Amphisphaeriales	MycoBank	-
Family	Sporocadaceae	MycoBank	1812776
Genus	Pestalotiopsis	MycoBank	37840

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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