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Compounds

COMPOUND NPA013708

STRUCTURE

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PROPERTIES

NPAID	NPA013708
CLUSTER ID	584
NODE ID	520
NAME	Sch 420789
FORMULA	C27H36O6
MOLECULAR WEIGHT (Da)	456.5790
ACCURATE MASS (Da)	456.2512
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Unknown-fungus
ORIGIN SPECIES	sp.
InChIKey	PDQFETFKTODSNI-JCKHCUFASA-N
InChI	InChI=1S/C27H36O6/c1-6-17(2)13-18(3)9-7-8-10-25(30)33-24-12-11-21(26(31)32)27(5)22(19(4)16-28)14-20(29)15-23(24)27/h7-10,15-18,21-22,24H,4,6,11-14H2,1-3,5H3,(H,31,32)/b9-7+,10-8+/t17?,18?,21-,22-,24-,27+/m0/s1
SMILES	CCC(C)CC(C)/C=C/C=C/C(=O)O[C@H]1CC[C@H]([C@]2(C1=CC(=O)C[C@H]2C(=C)C=O)C)C(=O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Puar, M S; Barrabee, E; Hallade, M; Patel, M Sch 420789: a novel fungal metabolite with phospholipase D inhibitory activity Journal of Antibiotics 2000 53 (8) 837-838.
DOI	10.7164/antibiotics.53.837	PMID	11079806

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Genus	Unknown-fungus	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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