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Compounds

COMPOUND NPA010399

STRUCTURE

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PROPERTIES

NPAID	NPA010399
CLUSTER ID	4160
NODE ID	3089
NAME	Emindole PA
FORMULA	C33H47NO2
MOLECULAR WEIGHT (Da)	489.7440
ACCURATE MASS (Da)	489.3607
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Emericella
ORIGIN SPECIES	purpurea
InChIKey	JVKLVZYMLNTAKF-KNGWZUEQSA-N
InChI	InChI=1S/C33H47NO2/c1-9-30(2,3)29-23(22-12-10-11-13-26(22)34-29)20-21-14-15-25-24(31(21,4)5)16-17-28-33(25,8)19-18-27(36-28)32(6,7)35/h9-13,16,21,25,27-28,34-35H,1,14-15,17-20H2,2-8H3/t21-,25+,27-,28-,33-/m0/s1
SMILES	C[C@@]12CC[C@H](O[C@H]1CC=C3[C@H]2CC[C@H](C3(C)C)CC4=C(NC5=CC=CC=C54)C(C)(C)C=C)C(C)(C)O

ORIGINAL ISOLATION REFERENCE

CITATION	Hosoe, Tomoo; Itabashi, Takeshi; Kobayashi, Nao; Udagawa, Shun-Ichi; Kawai, Ken-Ichi Three new types of indoloditerpenes, emindole PA-PC, from Emericella purpurea. Revision of the structure of emindole PA Chemical and Pharmaceutical Bulletin 2006 54 (2) 185-187.
DOI	10.1248/cpb.54.185	PMID	16462061

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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