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Compounds

COMPOUND NPA013306

STRUCTURE

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PROPERTIES

NPAID	NPA013306
CLUSTER ID	4889
NODE ID	3519
NAME	Penicitrinine A
FORMULA	C28H39NO6
MOLECULAR WEIGHT (Da)	485.6210
ACCURATE MASS (Da)	485.2777
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Penicillium
ORIGIN SPECIES	citrinum
InChIKey	YSKWCQSQBCPRCU-RSBNGFNNSA-N
InChI	InChI=1S/C28H39NO6/c1-8-9-10-11-12-14(2)24(31)23-26(32)28(29(7)27(23)33)17(5)25-22-20(35-28)13-19(30)16(4)21(22)15(3)18(6)34-25/h13-15,17-18,25,30,32H,8-12H2,1-7H3/t14?,15-,17-,18-,25-,28+/m1/s1
SMILES	CCCCCCC(C)C(=O)C1=C([C@@]2([C@@H]([C@@H]3C4=C([C@@H]([C@H](O3)C)C)C(=C(C=C4O2)O)C)C)N(C1=O)C)O

ORIGINAL ISOLATION REFERENCE

CITATION	Liu, Qin-Ying; Zhou, Tong; Zhao, Yang-Yang; Chen, Li; Gong, Mei-Wei; Xia, Qi-Wen; Ying, Min-Gang; Zheng, Qiu-Hong; Zhang, Qi-Qing Antitumor effects and related mechanisms of Penicitrinine A, a novel alkaloid with a unique spiro skeleton from the marine fungus Penicillium citrinum Marine Drugs 2015 13 (8) 4733-4753.
DOI	10.3390/md13084733	PMID	26264002

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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