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Compounds

COMPOUND NPA010423

STRUCTURE

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PROPERTIES

NPAID	NPA010423
CLUSTER ID	16
NODE ID	16
NAME	Achaetolide-II
FORMULA	C21H36O7
MOLECULAR WEIGHT (Da)	400.5120
ACCURATE MASS (Da)	400.2461
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Helminthosporium
ORIGIN SPECIES	velutinum TS28
InChIKey	FJSKPUJMHNGLPY-CBIPHORWSA-N
InChI	InChI=1S/C21H36O7/c1-4-5-6-7-8-9-16-12-19(24)18(23)11-10-17(13-20(25)27-16)28-21(26)14(2)15(3)22/h10-11,14-19,22-24H,4-9,12-13H2,1-3H3/b11-10+/t14-,15-,16+,17+,18+,19-/m0/s1
SMILES	CCCCCCC[C@@H]1C[C@@H]([C@@H](/C=C/[C@H](CC(=O)O1)OC(=O)[C@@H](C)[C@H](C)O)O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Arayama, Miki; Maeda, Hayato; Tanaka, Kazuaki; Takada, Noboru; Nehira, Tatsuo; Hashimoto, Masaru Achaetolide-II isolated from Helminthosporium velutinum TS28 Tetrahedron 2015 71 (41) 7900-7905.
DOI	10.1016/j.tet.2015.08.013	PMID	-

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Dothideomycetes	MycoBank	147541
Order	Pleosporales	MycoBank	92860
Family	Massarinaceae	MycoBank	290882
Genus	Helminthosporium	MycoBank	58127

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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