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Compounds

COMPOUND NPA011868

STRUCTURE

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PROPERTIES

NPAID	NPA011868
CLUSTER ID	442
NODE ID	400
NAME	Bionectriol D
FORMULA	C38H68O11
MOLECULAR WEIGHT (Da)	700.9510
ACCURATE MASS (Da)	700.4762
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Bionectria
ORIGIN SPECIES	ochroleuca
InChIKey	IXACCXKOOUBCOZ-SMYMJKOMSA-N
InChI	InChI=1S/C38H68O11/c1-12-19(2)13-20(3)14-26(9)36(49-38-35(45)34(44)33(43)29(18-39)48-38)27(10)17-24(7)31(41)22(5)15-21(4)30(40)23(6)16-25(8)32(42)28(11)37(46)47/h15-17,19-20,22-23,26-36,38-45H,12-14,18H2,1-11H3,(H,46,47)/b21-15+,24-17+,25-16+/t19-,20-,22-,23-,26-,27-,28+,29+,30+,31-,32+,33+,34-,35-,36+,38-/m0/s1
SMILES	CC[C@H](C)C[C@H](C)C[C@H](C)[C@H]([C@@H](C)/C=C(\C)/[C@H]([C@@H](C)/C=C(\C)/[C@H]([C@@H](C)/C=C(\C)/[C@H]([C@@H](C)C(=O)O)O)O)O)O[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Wang, Bin; You, Jianlan; King, Jarrod B.; Cai, Shengxin; Park, Elizabeth; Powell, Douglas R.; Cichewicz, Robert H. Polyketide glycosides from Bionectria ochroleuca inhibit Candida albicans biofilm formation Journal of Natural Products 2014 77 (10) 2273-2279.
DOI	10.1021/np500531j	PMID	25302529

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Sordariomycetes	MycoBank	147550
Order	Hypocreales	MycoBank	5125
Family	Bionectriaceae	MycoBank	103887
Genus	Bionectria	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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