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Compounds

COMPOUND NPA002495

STRUCTURE

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PROPERTIES

NPAID	NPA002495
CLUSTER ID	1476
NODE ID	1216
NAME	Oxachamigrene
FORMULA	C15H24BrClO
MOLECULAR WEIGHT (Da)	335.7130
ACCURATE MASS (Da)	334.0699
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Unknown-fungus
ORIGIN SPECIES	sp.
InChIKey	LBKDDPGYNQZCID-YSXHTJHHSA-N
InChI	InChI=1S/C15H24BrClO/c1-12(2)11-5-6-14(4,18-11)15(12)8-7-13(3,17)10(16)9-15/h10-11H,5-9H2,1-4H3/t10-,11?,13-,14?,15-/m1/s1
SMILES	C[C@]1(CC[C@@]2(C[C@H]1Br)C(C3CCC2(O3)C)(C)C)Cl

ORIGINAL ISOLATION REFERENCE

CITATION	Brito, Inmaculada; Cueto, Mercedes; Díaz-Marrero, Ana R; Darias, José; San Martín, Aurelio Oxachamigrenes, new halogenated sesquiterpenes from Laurencia obtusa Journal of Natural Products 2002 65 (6) 946-948.
DOI	10.1021/np010580t	PMID	12088448

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Genus	Unknown-fungus	MycoBank	-

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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