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Compounds

COMPOUND NPA007693

STRUCTURE

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PROPERTIES

NPAID	NPA007693
CLUSTER ID	3404
NODE ID	643
NAME	Pestalpolyol B
FORMULA	C25H42O4
MOLECULAR WEIGHT (Da)	406.6070
ACCURATE MASS (Da)	406.3083
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Pestalotiopsis
ORIGIN SPECIES	sp. cr013
InChIKey	CNANVYFHRUYPAQ-LPQRYZSGSA-N
InChI	InChI=1S/C25H42O4/c1-10-15(3)23(27)18(6)13-19(7)25(29)21(9)14-20(8)24(28)17(5)12-16(4)22(26)11-2/h10,12-14,17-18,21,23-25,27-29H,11H2,1-9H3/b15-10+,16-12+,19-13+,20-14+/t17-,18-,21-,23+,24-,25+/m0/s1
SMILES	CCC(=O)/C(=C/[C@H](C)[C@@H](/C(=C/[C@H](C)[C@@H](/C(=C/[C@H](C)[C@@H](/C(=C/C)/C)O)/C)O)/C)O)/C

ORIGINAL ISOLATION REFERENCE

CITATION	Li, Jing; Xie, Jin; Yang, Yin-He; Li, Xiao-Lian; Zeng, Ying; Zhao, Pei-Ji Pestalpolyols A-D, Cytotoxic Polyketides from Pestalotiopsis spcr013 Planta Medica 2015 81 (14) 1285-1289.
DOI	10.1055/s-0035-1546257	PMID	26227504

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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