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Compounds

COMPOUND NPA000470

STRUCTURE

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PROPERTIES

NPAID	NPA000470
CLUSTER ID	365
NODE ID	329
NAME	Anthcolorin A
FORMULA	C33H47NO3
MOLECULAR WEIGHT (Da)	505.7430
ACCURATE MASS (Da)	505.3556
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Aspergillus
ORIGIN SPECIES	versicolor
InChIKey	QWTTYYHQARGNPV-NWWFIIQASA-N
InChI	InChI=1S/C33H47NO3/c1-9-30(3,4)34-25-13-11-10-12-23(25)24(29(34)35)20-22-14-15-26-32(7,21(22)2)18-17-28-33(26,8)19-16-27(37-28)31(5,6)36/h9-13,22,24,26-28,36H,1-2,14-20H2,3-8H3/t22-,24+,26+,27-,28-,32+,33-/m0/s1
SMILES	C[C@@]12CC[C@H](O[C@H]1CC[C@]3([C@H]2CC[C@H](C3=C)C[C@@H]4C5=CC=CC=C5N(C4=O)C(C)(C)C=C)C)C(C)(C)O

ORIGINAL ISOLATION REFERENCE

CITATION	Nakanishi, Kyoko; Doi, Mitsunobu; Usami, Yoshihide; Amagata, Taro; Minoura, Katsuhiko; Tanaka, Reiko; Numata, Atsushi; Yamada, Takeshi Anthcolorins A-F, novel cytotoxic metabolites from a sea urchin-derived Aspergillus versicolor Tetrahedron 2013 69 (23) 4617-4623.
DOI	10.1016/j.tet.2013.04.011	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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