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Compounds

COMPOUND NPA022419

STRUCTURE

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PROPERTIES

NPAID	NPA022419
CLUSTER ID	6908
NODE ID	433
NAME	Emervaridone B
FORMULA	C25H28O4
MOLECULAR WEIGHT (Da)	392.4950
ACCURATE MASS (Da)	392.1988
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Emericella
ORIGIN SPECIES	sp. TJ29
InChIKey	ARYKIJCLHMOALX-GIZQAJFUSA-N
InChI	InChI=1S/C25H28O4/c1-13-17-18-23(5)8-7-16(26)21(2,3)15(23)6-9-24(18)11-22(4,19(17)27)10-14-20(28)29-12-25(13,14)24/h7-8,10,15,17-18H,1,6,9,11-12H2,2-5H3/t15-,17-,18-,22+,23-,24-,25-/m0/s1
SMILES	C[C@@]12C[C@@]34CC[C@@H]5[C@@]([C@@H]3[C@@H](C1=O)C(=C)[C@]46COC(=O)C6=C2)(C=CC(=O)C5(C)C)C

ORIGINAL ISOLATION REFERENCE

CITATION	He, Yan; Hu, Zhengxi; Li, Qin; Huang, Jinfeng; Li, Xiao-Nian; Zhu, Hucheng; Liu, Junjun; Wang, Jianping; Xue, Yongbo; Zhang, Yonghui Bioassay-Guided Isolation of Antibacterial Metabolites from Emericella sp. TJ29 Journal of Natural Products 2017 80 (9) 2399-2405.
DOI	10.1021/acs.jnatprod.7b00077	PMID	28901763

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	Trichocomaceae	MycoBank	28568
Genus	Emericella	MycoBank	5071

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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