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Compounds

COMPOUND NPA001751

STRUCTURE

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PROPERTIES

NPAID	NPA001751
CLUSTER ID	181
NODE ID	169
NAME	Ascosteroside B
FORMULA	C36H56O9
MOLECULAR WEIGHT (Da)	632.8350
ACCURATE MASS (Da)	632.3924
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Unknown-fungus
ORIGIN SPECIES	sp.
InChIKey	MCYFTUBTCPLGQB-YYCFVYRFSA-N
InChI	InChI=1S/C36H56O9/c1-19(2)9-8-10-20(3)25-17-28(38)36(33(41)42)24-12-11-22-21(4)26(14-15-34(22,5)23(24)13-16-35(25,36)6)44-32-30(40)29(39)31(43-7)27(18-37)45-32/h9,20,22,25-32,37-40H,4,8,10-18H2,1-3,5-7H3,(H,41,42)/t20-,22+,25-,26+,27-,28-,29-,30-,31-,32+,34+,35-,36-/m1/s1
SMILES	C[C@H](CCC=C(C)C)[C@H]1C[C@H]([C@@]2([C@@]1(CCC3=C2CC[C@@H]4[C@@]3(CC[C@@H](C4=C)O[C@@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)OC)O)O)C)C)C(=O)O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Weber, Roland W.S.; Kappe, Reinhard; Paululat, Thomas; Moesker, Eva; Anke, Heidrun Anti-Candida metabolites from endophytic fungi Phytochemistry 2007 68 (6) 886-892.
DOI	10.1016/j.phytochem.2006.12.017	PMID	17286994

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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