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Compounds

COMPOUND NPA032237

STRUCTURE

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PROPERTIES

NPAID	NPA032237
CLUSTER ID	9387
NODE ID	6292
NAME	Anaenoic acid
FORMULA	C22H32O7
MOLECULAR WEIGHT (Da)	408.4910
ACCURATE MASS (Da)	408.2148
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Hormoscilla
ORIGIN SPECIES	sp.
InChIKey	TYXOAKSZEQQQPP-YZVOILCLSA-N
InChI	InChI=1S/C22H32O7/c1-6-8-9-11-16-12-10-13-17(27-5)18(16)21(25)29-19(14(3)7-2)22(26)28-15(4)20(23)24/h10,12-15,19H,6-9,11H2,1-5H3,(H,23,24)/t14-,15-,19+/m0/s1
SMILES	CCCCCC1=C(C(=O)O[C@@H](C(=O)O[C@@H](C)C(=O)O)[C@@H](C)CC)C(OC)=CC=C1

ORIGINAL ISOLATION REFERENCE

CITATION	Brumley, David A; Gunasekera, Sarath P; Chen, Qi-Yin; Paul, Valerie J; Luesch, Hendrik Discovery, Total Synthesis, and SAR of Anaenamides A and B: Anticancer Cyanobacterial Depsipeptides with a Chlorinated Pharmacophore. Organic Letters 2020 22 (11) 4235-4239.
DOI	10.1021/acs.orglett.0c01281	PMID	32418432

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Cyanobacteria	LPSN	1117
Class	Cyanophyceae	LPSN	-
Order	Oscillatoriales	LPSN	1150
Family	Gomontiellaceae	LPSN	1892255
Genus	Hormoscilla	LPSN	881023

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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