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Compounds

COMPOUND NPA001610

STRUCTURE

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PROPERTIES

NPAID	NPA001610
CLUSTER ID	172
NODE ID	161
NAME	Ochrindole A
FORMULA	C29H28N2O3
MOLECULAR WEIGHT (Da)	452.5540
ACCURATE MASS (Da)	452.2100
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Aspergillus
ORIGIN SPECIES	ochraceus NRRL 3519
InChIKey	YVQFFNCNPFQQKW-UHFFFAOYSA-N
InChI	InChI=1S/C29H28N2O3/c1-17(2)13-14-20-25(21-15-30-23-11-7-5-9-18(21)23)29(34-4)27(32)26(28(20)33-3)22-16-31-24-12-8-6-10-19(22)24/h5-13,15-16,30-32H,14H2,1-4H3
SMILES	CC(=CCC1=C(C(=C(C(=C1OC)C2=CNC3=CC=CC=C32)O)OC)C4=CNC5=CC=CC=C54)C

ORIGINAL ISOLATION REFERENCE

CITATION	De Guzman; Bruss; Rippentrop; Gloer; Wicklow; Dowd Ochrindoles A-D: New bis-indolyl benzenoids from the sclerotia of Aspergillus ochraceus NRRL 3519 Journal of Natural Products 1994 57 (5) 634-639.
DOI	10.1021/np50107a011	PMID	-

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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