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Compounds

COMPOUND NPA032239

STRUCTURE

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PROPERTIES

NPAID	NPA032239
CLUSTER ID	9387
NODE ID	6292
NAME	Anaenamide B
FORMULA	C27H38ClNO8
MOLECULAR WEIGHT (Da)	540.0530
ACCURATE MASS (Da)	539.2286
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Hormoscilla
ORIGIN SPECIES	sp.
InChIKey	IXCTXXVLJZQBQP-WNFKXCOPSA-N
InChI	InChI=1S/C27H38ClNO8/c1-7-9-10-12-19-13-11-14-21(34-5)22(19)26(32)37-23(17(3)8-2)27(33)36-18(4)24(30)29-16-15-20(28)25(31)35-6/h11,13-15,17-18,23H,7-10,12,16H2,1-6H3,(H,29,30)/b20-15+/t17-,18-,23+/m0/s1
SMILES	CCCCCC1=C(C(=O)O[C@@H](C(=O)O[C@@H](C)C(=O)NC/C=C(/Cl)C(=O)OC)[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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