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Compounds

COMPOUND NPA023840

STRUCTURE

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PROPERTIES

NPAID	NPA023840
CLUSTER ID	7304
NODE ID	5012
NAME	Pseudallicin D
FORMULA	C40H59NO5
MOLECULAR WEIGHT (Da)	633.9140
ACCURATE MASS (Da)	633.4393
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Pseudallescheria
ORIGIN SPECIES	boydii SNB-CN85
InChIKey	VIDGNJPCBMOYMK-FPYCVEBQSA-N
InChI	InChI=1S/C40H59NO5/c1-9-28(4)23-29(5)14-10-11-15-38(44)35(24-32-17-19-33(42)20-18-32)41(8)36-26-40(46-39(36)45)22-21-30(6)34(25-40)31(7)37(43)16-12-13-27(2)3/h10,13-14,17-20,26,28-29,31,34-35,38,42,44H,6,9,11-12,15-16,21-25H2,1-5,7-8H3/t28-,29+,31+,34+,35+,38-,40+/m1/s1
SMILES	CC[C@@H](C)C[C@@H](C)C=CCC[C@H]([C@H](CC1=CC=C(C=C1)O)N(C)C2=C[C@@]3(CCC(=C)[C@H](C3)[C@H](C)C(=O)CCC=C(C)C)OC2=O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Sorres, Jonathan; Nirma, Charlotte; Eparvier, Véronique; Stien, Didier Pseudallicins A-D: Four Complex Ovalicin Derivatives from Pseudallescheria boydii SNB-CN85 Organic Letters 2017 19 (15) 3978-3981.
DOI	10.1021/acs.orglett.7b01671	PMID	28708403

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Sordariomycetes	MycoBank	147550
Order	Microascales	MycoBank	5592
Family	Microascaceae	MycoBank	5593
Genus	Pseudallescheria	MycoBank	5596

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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