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Compounds

COMPOUND NPA031326

STRUCTURE

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PROPERTIES

NPAID	NPA031326
CLUSTER ID	1027
NODE ID	885
NAME	Lyngbyatoxin B
FORMULA	C27H39N3O3
MOLECULAR WEIGHT (Da)	453.6270
ACCURATE MASS (Da)	453.2991
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Lyngbya
ORIGIN SPECIES	majuscula
InChIKey	RLQWNZUFDRUTMZ-LERHOHMLSA-N
InChI	InChI=1S/C27H39N3O3/c1-8-27(6,12-11-22(32)16(2)3)20-9-10-21-23-18(14-28-24(20)23)13-19(15-31)29-26(33)25(17(4)5)30(21)7/h8-10,14,17,19,22,25,28,31-32H,1-2,11-13,15H2,3-7H3,(H,29,33)/t19-,22?,25-,27-/m0/s1
SMILES	C=C[C@@](C)(CCC(O)C(=C)C)C1=C2NC=C3C[C@@H](CO)NC(=O)[C@H](C(C)C)N(C)C(=C32)C=C1

ORIGINAL ISOLATION REFERENCE

CITATION	Norio Aimi, Hideo Odaka, Shin-ichiro Sakai, Hirota Fujiki, Masami Suganuma, Richard E. Moore, and Gergory M. L Patterson Lyngbyatoxins B and C, two new irritants from Lyngbya majuscula. Journal of Natural Products 1990 53 (6) 1593-1596.
DOI	10.1021/np50072a035	PMID	2128518

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Cyanobacteria	LPSN	1117
Class	Cyanophyceae	LPSN	-
Order	Oscillatoriales	LPSN	1150
Family	Oscillatoriaceae	LPSN	1892254
Genus	Lyngbya	LPSN	28073

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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