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Compounds

COMPOUND NPA002644

STRUCTURE

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PROPERTIES

NPAID	NPA002644
CLUSTER ID	1557
NODE ID	148
NAME	Smardaesidin C
FORMULA	C20H30O4
MOLECULAR WEIGHT (Da)	334.4560
ACCURATE MASS (Da)	334.2144
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Smardaea
ORIGIN SPECIES	sp. AZ0432
InChIKey	FNUBWHKNLAHVEZ-UEKXCGIHSA-N
InChI	InChI=1S/C20H30O4/c1-5-17(4)8-9-19(22)14(10-17)20(23)11-13-16(2,3)7-6-15(21)18(13,19)12-24-20/h5,10,13,15,21-23H,1,6-9,11-12H2,2-4H3/t13-,15+,17-,18+,19+,20-/m0/s1
SMILES	C[C@@]1(CC[C@]2(C(=C1)[C@@]3(C[C@@H]4[C@]2(CO3)[C@@H](CCC4(C)C)O)O)O)C=C

ORIGINAL ISOLATION REFERENCE

CITATION	Wang, Xiao-Ning; Bashyal, Bharat P.; Wijeratne, E. M. Kithsiri; U'Ren, Jana M.; Liu, Manping X.; Gunatilaka, Malkanthi K.; Arnold, A. Elizabeth; Gunatilaka, A. A. Leslie Smardaesidins A-G, isopimarane and 20 nor-isopimarane diterpenoids from Smardaea sp., a fungal endophyte of the moss Ceratodon purpureus (1) Journal of Natural Products 2011 74 (10) 2052-2061.
DOI	10.1021/np2000864	PMID	21999655

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Pezizomycetes	MycoBank	147549
Order	Pezizales	MycoBank	5185
Family	Pyronemataceae	MycoBank	110846
Genus	Smardaea	MycoBank	173111

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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