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Compounds

COMPOUND NPA019907

STRUCTURE

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PROPERTIES

NPAID	NPA019907
CLUSTER ID	57
NODE ID	53
NAME	Scoparasin A
FORMULA	C29H35NO8
MOLECULAR WEIGHT (Da)	525.5980
ACCURATE MASS (Da)	525.2363
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Eutypella
ORIGIN SPECIES	scoparia PSU-D44
InChIKey	UKXQRSOMKIGRCJ-ZLVRRUFZSA-N
InChI	InChI=1S/C29H35NO8/c1-16-7-6-8-21-24(31)18(3)17(2)23-22(15-19-9-11-20(36-5)12-10-19)30-26(33)29(21,23)38-27(34)37-14-13-28(4,35)25(16)32/h6,8-14,16,21-24,31,35H,7,15H2,1-5H3,(H,30,33)/b8-6+,14-13+/t16-,21-,22-,23-,24+,28+,29+/m1/s1
SMILES	C[C@@H]1C/C=C/[C@@H]2[C@H](C(=C([C@H]3[C@@]2(C(=O)N[C@@H]3CC4=CC=C(C=C4)OC)OC(=O)O/C=C/[C@](C1=O)(C)O)C)C)O

ORIGINAL ISOLATION REFERENCE

CITATION	Pongcharoen, Wipapan; Rukachaisirikul, Vatcharin; Phongpaichit, Souwalak; Rungjindarnai, Nattawut; Sakayaroj, Jariya Pimarane diterpene and cytochalasin derivatives from the endophytic fungus Eutypella scoparia PSU-D44 Journal of Natural Products 2006 69 (5) 856-858.
DOI	10.1021/np0600649	PMID	16724861

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Sordariomycetes	MycoBank	147550
Order	Xylariales	MycoBank	37989
Family	Diatrypaceae	MycoBank	42364
Genus	Eutypella	MycoBank	140192

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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