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Compounds

COMPOUND NPA022759

STRUCTURE

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EXTERNAL LINKS

PROPERTIES

NPAID	NPA022759
CLUSTER ID	114
NODE ID	108
NAME	Exserolide I
FORMULA	C16H20O7
MOLECULAR WEIGHT (Da)	324.3290
ACCURATE MASS (Da)	324.1209
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Setosphaeria
ORIGIN SPECIES	sp. SCSIO41009
InChIKey	YJAAFPMLPPQOOG-OLXJLDBKSA-N
InChI	InChI=1S/C16H20O7/c1-20-10-7-9-12(13(18)15(10)21-2)16(19)23-11-6-8(4-3-5-17)22-14(9)11/h7-8,11,14,17-18H,3-6H2,1-2H3/t8-,11+,14+/m0/s1
SMILES	COC1=C(C(=C2C(=C1)[C@@H]3[C@@H](C[C@@H](O3)CCCO)OC2=O)O)OC

ORIGINAL ISOLATION REFERENCE

CITATION	Pang, Xiaoyan; Lin, Xiuping; Yang, Jie; Zhou, Xuefeng; Yang, Bin; Wang, Junfeng; Liu, Yonghong Spiro-Phthalides and Isocoumarins Isolated from the Marine-Sponge-Derived Fungus Setosphaeria sp. SCSIO41009. Journal of Natural Products 2018 81 (8) 1860-1868.
DOI	10.1021/acs.jnatprod.8b00345	PMID	30091601

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Dothideomycetes	MycoBank	147541
Order	Pleosporales	MycoBank	92860
Family	Pleosporaceae	MycoBank	28556
Genus	Setosphaeria	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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