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Compounds

COMPOUND NPA001410

STRUCTURE

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PROPERTIES

NPAID	NPA001410
CLUSTER ID	923
NODE ID	798
NAME	Sclerotiotide C
FORMULA	C24H38N4O4
MOLECULAR WEIGHT (Da)	446.5920
ACCURATE MASS (Da)	446.2893
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Aspergillus
ORIGIN SPECIES	sclerotiorum PT06-1
InChIKey	WTFVTPDZPCKVCO-FPSIIMKOSA-N
InChI	InChI=1S/C24H38N4O4/c1-7-8-9-10-11-15-20(29)26-19-14-12-13-16-25-22(30)18(4)27(5)24(32)21(17(2)3)28(6)23(19)31/h7-11,15,17-19,21H,12-14,16H2,1-6H3,(H,25,30)(H,26,29)/b8-7+,10-9+,15-11+/t18-,19-,21-/m0/s1
SMILES	C/C=C/C=C/C=C/C(=O)N[C@H]1CCCCNC(=O)[C@@H](N(C(=O)[C@@H](N(C1=O)C)C(C)C)C)C

ORIGINAL ISOLATION REFERENCE

CITATION	Zheng, Jinkai; Xu, Zhihong; Wang, Yi; Hong, Kui; Liu, Peipei; Zhu, Weiming Cyclic tripeptides from the halotolerant fungus Aspergillus sclerotiorum PT06-1 Journal of Natural Products 2010 73 (6) 1133-1137.
DOI	10.1021/np100198h	PMID	20503985

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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