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Compounds

COMPOUND NPA016661

STRUCTURE

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PROPERTIES

NPAID	NPA016661
CLUSTER ID	105
NODE ID	100
NAME	Squalestatin V
FORMULA	C33H44O13
MOLECULAR WEIGHT (Da)	648.7020
ACCURATE MASS (Da)	648.2782
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Phoma
ORIGIN SPECIES	sp.
InChIKey	CFPDXPJILKOANL-MSEFWFOLSA-N
InChI	InChI=1S/C33H44O13/c1-6-19(2)18-30(5,42)14-13-23(34)44-25-24(35)31(15-12-20(3)16-21(4)17-22-10-8-7-9-11-22)45-26(27(36)37)32(43,28(38)39)33(25,46-31)29(40)41/h7-11,13-14,16,19,21,24-26,35,42-43H,6,12,15,17-18H2,1-5H3,(H,36,37)(H,38,39)(H,40,41)/b14-13+,20-16+/t19?,21?,24-,25-,26-,30?,31+,32-,33+/m1/s1
SMILES	CCC(C)CC(C)(/C=C/C(=O)O[C@@H]1[C@H]([C@]2(O[C@@H]([C@]([C@@]1(O2)C(=O)O)(C(=O)O)O)C(=O)O)CC/C(=C/C(C)CC3=CC=CC=C3)/C)O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Blows; Foster; Lane; Noble; Piercey; Sidebottom; Webb The squalestatins, novel inhibitors of squalene synthase produced by a species of Phoma. V. Minor metabolites Journal of Antibiotics 1994 47 (7) 740-754.
DOI	10.7164/antibiotics.47.740	PMID	8071119

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
Genus	Phoma	MycoBank	37463

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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