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Compounds

COMPOUND NPA002901

STRUCTURE

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PROPERTIES

NPAID	NPA002901
CLUSTER ID	1670
NODE ID	1364
NAME	Pestalochromone B
FORMULA	C12H17ClO5
MOLECULAR WEIGHT (Da)	276.7160
ACCURATE MASS (Da)	276.0765
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Pestalotiopsis
ORIGIN SPECIES	sp. PSU-MA69
InChIKey	DEZSZDHQEFMIGP-LOKLDPHHSA-N
InChI	InChI=1S/C12H17ClO5/c1-12(2)4-5(14)6-10(18-12)7(13)8(15)9(16)11(6)17-3/h7-9,11,15-16H,4H2,1-3H3/t7-,8+,9-,11+/m1/s1
SMILES	CC1(CC(=O)C2=C(O1)[C@@H]([C@@H]([C@H]([C@H]2OC)O)O)Cl)C

ORIGINAL ISOLATION REFERENCE

CITATION	Klaiklay, Saranyoo; Rukachaisirikul, Vatcharin; Tadpetch, Kwanruthai; Sukpondma, Yaowapa; Phongpaichit, Souwalak; Buatong, Jirayu; Sakayaroj, Jariya Chlorinated chromone and diphenyl ether derivatives from the mangrove-derived fungus Pestalotiopsis sp. PSU-MA69 Tetrahedron 2012 68 (10) 2299-2305.
DOI	10.1016/j.tet.2012.01.041	PMID	-

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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