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Compounds

COMPOUND NPA023879

STRUCTURE

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PROPERTIES

NPAID	NPA023879
CLUSTER ID	7289
NODE ID	365
NAME	Diaporisoindole C
FORMULA	C50H54N2O8
MOLECULAR WEIGHT (Da)	810.9880
ACCURATE MASS (Da)	810.3880
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Diaporthe
ORIGIN SPECIES	sp. SYSU-HQ3
InChIKey	HDRUNFXHQOQTHT-UWXQCODUSA-N
InChI	InChI=1S/C50H54N2O8/c1-25(2)11-13-29-15-17-33(53)41-39(29)43(31-19-27(5)21-35-47(31)59-37(23-57-35)49(7,8)55)51-45(41)46-42-34(54)18-16-30(14-12-26(3)4)40(42)44(52-46)32-20-28(6)22-36-48(32)60-38(24-58-36)50(9,10)56/h11-12,15-22,37-38,53-56H,13-14,23-24H2,1-10H3/t37-,38-/m0/s1
SMILES	CC1=CC2=C(C(=C1)C3=NC(=C4C5=C(C=CC(=C5C(=N4)C6=CC(=CC7=C6O[C@@H](CO7)C(C)(C)O)C)CC=C(C)C)O)C8=C(C=CC(=C83)CC=C(C)C)O)O[C@@H](CO2)C(C)(C)O

ORIGINAL ISOLATION REFERENCE

CITATION	Cui, Hui; Lin, Yun; Luo, Mingchu; Lu, Yongjun; Huang, Xishan; She, Zhigang Diaporisoindoles A-C: Three Isoprenylisoindole Alkaloid Derivatives from the Mangrove Endophytic Fungus Diaporthe sp. SYSU-HQ3 Organic Letters 2017 19 (20) 5621-5624.
DOI	10.1021/acs.orglett.7b02748	PMID	28961015

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Sordariomycetes	MycoBank	147550
Order	Diaporthales	MycoBank	5114
Family	Diaporthaceae	MycoBank	767018
Genus	Diaporthe	MycoBank	36922

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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