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Compounds

COMPOUND NPA016119

STRUCTURE

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EXTERNAL LINKS

PROPERTIES

NPAID	NPA016119
CLUSTER ID	3783
NODE ID	2839
NAME	9-deacetylfumigaclavine C
FORMULA	C21H28N2O
MOLECULAR WEIGHT (Da)	324.4680
ACCURATE MASS (Da)	324.2202
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Aspergillus
ORIGIN SPECIES	fumigatus
InChIKey	VCXCXXJJHZVDSD-GJGHSUIPSA-N
InChI	InChI=1S/C21H28N2O/c1-6-21(3,4)20-14-10-16-18(19(24)12(2)11-23(16)5)13-8-7-9-15(22-20)17(13)14/h6-9,12,16,18-19,22,24H,1,10-11H2,2-5H3/t12-,16+,18+,19-/m0/s1
SMILES	C[C@H]1CN([C@@H]2CC3=C(NC4=CC=CC(=C34)[C@H]2[C@H]1O)C(C)(C)C=C)C

ORIGINAL ISOLATION REFERENCE

CITATION	Hui, Ming Ge; Zhi, Guo Yu; Zhang, Jie; Jun, Hua Wu; Ren, Xiang Tan Bioactive alkaloids from endophytic Aspergillus fumigatus Journal of Natural Products 2009 72 (4) 753-755.
DOI	10.1021/np800700e	PMID	19256529

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Eurotiomycetes	MycoBank	147545
Order	Eurotiales	MycoBank	5042
Family	Aspergillaceae	MycoBank	1131492
Genus	Aspergillus	MycoBank	5052

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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