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Compounds

COMPOUND NPA010060

STRUCTURE

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PROPERTIES

NPAID	NPA010060
CLUSTER ID	26
NODE ID	25
NAME	Cristatin A
FORMULA	C29H37N3O2
MOLECULAR WEIGHT (Da)	459.6340
ACCURATE MASS (Da)	459.2886
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Aspergillus
ORIGIN SPECIES	restrictus
InChIKey	RERRWNNFPWXUTC-UZXDDYOISA-N
InChI	InChI=1S/C29H37N3O2/c1-9-29(7,8)26-23(16-24-28(34)30-19(6)27(33)31-24)22-15-13-20(12-10-17(2)3)21(25(22)32-26)14-11-18(4)5/h9-11,13,15-16,19,32H,1,12,14H2,2-8H3,(H,30,34)(H,31,33)/b24-16-/t19-/m0/s1
SMILES	C[C@H]1C(=O)N/C(=C\C2=C(NC3=C2C=CC(=C3CC=C(C)C)CC=C(C)C)C(C)(C)C=C)/C(=O)N1

ORIGINAL ISOLATION REFERENCE

CITATION	Itabashi, Takeshi; Matsuishi, Natsuna; Hosoe, Tomoo; Toyazaki, Norihiro; Udagawa, Shun-Ichi; Imai, Toshimichi; Adachi, Mitsuru; Kawai, Ken-Ichi Two new dioxopiperazine derivatives, arestrictins A and B, isolated from Aspergillus restrictus and Aspergillus penicilloides Chemical and Pharmaceutical Bulletin 2006 54 (12) 1639-1641.
DOI	10.1248/cpb.54.1639	PMID	17139096

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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