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Compounds

ID	Spectrum Quality	Annotated Name
CCMSLIB00004681489	Bronze	Fumonisin&B1
CCMSLIB00005727056	Gold	3
CCMSLIB00005727205	Gold	3
CCMSLIB00005727877	Gold	3
CCMSLIB00005727752	Gold	3
CCMSLIB00005727112	Gold	3
CCMSLIB00005727082	Gold	3
CCMSLIB00005727715	Gold	3
CCMSLIB00005727595	Gold	3
CCMSLIB00005727209	Gold	3
CCMSLIB00005773719	Gold	3
CCMSLIB00005775614	Gold	3
CCMSLIB00005776373	Gold	3
CCMSLIB00005773200	Gold	3
CCMSLIB00005772889	Gold	3
CCMSLIB00000849080	Gold	1!CCMSLIB00000845370
CCMSLIB00003134594	Gold	3
CCMSLIB00003137075	Gold	3
CCMSLIB00012113081	Gold	4
CCMSLIB00012113082	Gold	4
CCMSLIB00009952878	Gold	4
CCMSLIB00009952879	Gold	4
CCMSLIB00012113083	Gold	4
CCMSLIB00012113084	Gold	4
CCMSLIB00012113085	Gold	4
CCMSLIB00009952880	Gold	4
CCMSLIB00009952881	Gold	4
CCMSLIB00009952882	Gold	4
CCMSLIB00012133609	Gold	4
CCMSLIB00012133612	Gold	4
CCMSLIB00012133610	Gold	4
CCMSLIB00012133607	Gold	4
CCMSLIB00012133605	Gold	4
CCMSLIB00012133606	Gold	4
CCMSLIB00012133608	Gold	4
CCMSLIB00012133611	Gold	4
CCMSLIB00012133614	Gold	4
CCMSLIB00012133615	Gold	4
CCMSLIB00012133613	Gold	4
CCMSLIB00009973406	Gold	4
CCMSLIB00009973409	Gold	4
CCMSLIB00009973407	Gold	4
CCMSLIB00009973404	Gold	4
CCMSLIB00009973402	Gold	4
CCMSLIB00009973403	Gold	4
CCMSLIB00009973405	Gold	4
CCMSLIB00009973408	Gold	4
CCMSLIB00009973411	Gold	4
CCMSLIB00009973412	Gold	4
CCMSLIB00009973410	Gold	4

COMPOUND NPA012054

STRUCTURE

Image structure

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EXTERNAL LINKS

PROPERTIES

NPAID	NPA012054
CLUSTER ID	491
NODE ID	441
NAME	Fumonisin B1
FORMULA	C34H59NO15
MOLECULAR WEIGHT (Da)	721.8380
ACCURATE MASS (Da)	721.3885
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Fusarium
ORIGIN SPECIES	moniliforme MRC 826
InChIKey	UVBUBMSSQKOIBE-NDFMDLIYSA-N
InChI	InChI=1S/C34H59NO15/c1-5-6-9-20(3)32(50-31(44)17-23(34(47)48)15-29(41)42)27(49-30(43)16-22(33(45)46)14-28(39)40)13-19(2)12-24(36)10-7-8-11-25(37)18-26(38)21(4)35/h19-27,32,36-38H,5-18,35H2,1-4H3,(H,39,40)(H,41,42)(H,45,46)(H,47,48)/t19-,20+,21-,22-,23-,24+,25+,26-,27-,32+/m0/s1
SMILES	CCCC[C@@H](C)[C@H]([C@H](C[C@@H](C)C[C@@H](CCCC[C@H](C[C@@H]([C@H](C)N)O)O)O)OC(=O)C[C@H](CC(=O)O)C(=O)O)OC(=O)C[C@H](CC(=O)O)C(=O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Gelderblom, W C; Jaskiewicz, K; Marasas, W F; Thiel, P G; Horak, R M; Vleggaar, R; Kriek, N P Fumonisins-novel mycotoxins with cancer-promoting activity produced by Fusarium moniliforme Applied and Environmental Microbiology 1988 54 (7) 1806-1811.
DOI	10.5281/zenodo.3541285	PMID	2901247

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	Nectriaceae	MycoBank	110618
Genus	Fusarium	MycoBank	5506

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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