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Compounds

COMPOUND NPA028305

STRUCTURE

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PROPERTIES

NPAID	NPA028305
CLUSTER ID	282
NODE ID	256
NAME	Penicimutanolone B
FORMULA	C26H41NO7
MOLECULAR WEIGHT (Da)	479.6140
ACCURATE MASS (Da)	479.2883
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Penicillium
ORIGIN SPECIES	purpurogenum 3-f-31
InChIKey	NXJZEVNYGRKUJJ-FFJBMXIDSA-N
InChI	InChI=1S/C26H41NO7/c1-5-6-7-8-9-15(2)12-16(3)10-11-19(29)27-18-14-26(34-24(18)30)22-20(32-22)25(31,13-17(4)28)21-23(26)33-21/h10-11,15-16,18,20-24,30-31H,5-9,12-14H2,1-4H3,(H,27,29)/b11-10+/t15-,16+,18-,20-,21+,22+,23-,24?,25?,26?/m1/s1
SMILES	CCCCCC[C@@H](C)C[C@@H](C)/C=C/C(=O)N[C@@H]1CC2(OC1O)[C@H]1O[C@H]1C(O)(CC(C)=O)[C@H]1O[C@H]12

ORIGINAL ISOLATION REFERENCE

CITATION	Wang, Nan; Li, Chang-Wei; Cui, Cheng-Bin; Cai, Bing; Xu, Lan-Lan; Zhu, Hua-Jie Four new antitumor metabolites isolated from a mutant 3-f-31 strain derived from Penicillium purpurogenum G59 European Journal of Medicinal Chemistry 2018 158 548-558.
DOI	10.1016/j.ejmech.2018.09.015	PMID	30243156

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Eurotiomycetes	MycoBank	147545
Order	Eurotiales	MycoBank	5042
Family	Aspergillaceae	MycoBank	1131492
Genus	Penicillium	MycoBank	5073

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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