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Compounds

COMPOUND NPA013450

STRUCTURE

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PROPERTIES

NPAID	NPA013450
CLUSTER ID	282
NODE ID	256
NAME	Gymnastatin A
FORMULA	C23H31Cl2NO4
MOLECULAR WEIGHT (Da)	456.4100
ACCURATE MASS (Da)	455.1630
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Gymnascella
ORIGIN SPECIES	dankaliensis
InChIKey	NGXMXBNROHVABT-FYPVGPPLSA-N
InChI	InChI=1S/C23H31Cl2NO4/c1-4-5-6-7-8-15(2)11-16(3)9-10-20(27)26-19-14-23(30-22(19)29)12-17(24)21(28)18(25)13-23/h9-13,15,19,22,29H,4-8,14H2,1-3H3,(H,26,27)/b10-9+,16-11+/t15?,19-,22?/m0/s1
SMILES	CCCCCCC(C)/C=C(\C)/C=C/C(=O)N[C@H]1CC2(C=C(C(=O)C(=C2)Cl)Cl)OC1O

ORIGINAL ISOLATION REFERENCE

CITATION	Numata, Atsushi; Amagata, Taro; Minoura, Katsuhiko; Ito, Tadayoshi Gymnastatins, novel cytotoxic metabolites produced by a fungal strain from a sponge Tetrahedron Letters 1997 38 (32) 5675-5678.
DOI	10.1016/s0040-4039(97)01236-7	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	Onygenales	MycoBank	33183
Family	Gymnoascaceae	MycoBank	37243
Genus	Gymnascella	MycoBank	78593

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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