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Compounds

COMPOUND NPA004131

STRUCTURE

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PROPERTIES

NPAID	NPA004131
CLUSTER ID	26
NODE ID	25
NAME	5-N-acetyl-16α-hydroxyardeemin
FORMULA	C28H28N4O4
MOLECULAR WEIGHT (Da)	484.5560
ACCURATE MASS (Da)	484.2111
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Aspergillus
ORIGIN SPECIES	fumigatus SPS-02
InChIKey	NZEBQKVTPTVMHB-XEFJRJENSA-N
InChI	InChI=1S/C28H28N4O4/c1-6-27(4,5)28-18-12-8-10-14-20(18)31(16(3)33)26(28)32-21(22(28)34)23-29-19-13-9-7-11-17(19)25(36)30(23)15(2)24(32)35/h6-15,21-22,26,34H,1H2,2-5H3/t15-,21+,22+,26+,28+/m1/s1
SMILES	C[C@@H]1C(=O)N2[C@@H]([C@@H]([C@@]3([C@H]2N(C4=CC=CC=C43)C(=O)C)C(C)(C)C=C)O)C5=NC6=CC=CC=C6C(=O)N15

ORIGINAL ISOLATION REFERENCE

CITATION	Zhang, Hua-Wei; Ying, Chen; Tang, Yi-Fei Four ardeemin analogs from endophytic Aspergillus fumigatus SPS-02 and their reversal effects on multidrug-resistant tumor cells Chemistry and Biodiversity 2014 11 (1) 85-91.
DOI	10.1002/cbdv.201300220	PMID	24443428

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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