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Compounds

COMPOUND NPA015561

STRUCTURE

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PROPERTIES

NPAID	NPA015561
CLUSTER ID	5408
NODE ID	3848
NAME	Cryptosphaerolide
FORMULA	C26H42O7
MOLECULAR WEIGHT (Da)	466.6150
ACCURATE MASS (Da)	466.2931
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Cryptosphaeria
ORIGIN SPECIES	sp. CNL-523
InChIKey	MMGJJGNQFININV-OPYLLRRUSA-N
InChI	InChI=1S/C26H42O7/c1-7-15(2)10-16(3)11-24(29,14-27)22(28)32-20-9-8-18(5)23(6)12-19-17(4)13-31-26(19,30)21-25(20,23)33-21/h15-16,18-21,27,29-30H,4,7-14H2,1-3,5-6H3/t15?,16?,18-,19-,20+,21-,23+,24?,25+,26+/m0/s1
SMILES	CCC(C)CC(C)CC(CO)(C(=O)O[C@@H]1CC[C@@H]([C@@]2([C@]13[C@H](O3)[C@]4([C@@H](C2)C(=C)CO4)O)C)C)O

ORIGINAL ISOLATION REFERENCE

CITATION	Oh, Hyuncheol; Jensen, Paul R.; Murphy, Brian T.; Fiorilla, Catherine; Sullivan, John F.; Ramsey, Timothy; Fenical, William Cryptosphaerolide, a cytotoxic Mcl-1 inhibitor from a marine-derived ascomycete related to the genus Cryptosphaeria Journal of Natural Products 2010 73 (5) 998-1001.
DOI	10.1021/np1000889	PMID	20462271

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Sordariomycetes	MycoBank	147550
Order	Xylariales	MycoBank	37989
Family	Diatrypaceae	MycoBank	42364
Genus	Cryptosphaeria	MycoBank	140164

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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