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Compounds

COMPOUND NPA022396

STRUCTURE

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PROPERTIES

NPAID	NPA022396
CLUSTER ID	6902
NODE ID	4768
NAME	Spirograterpene A
FORMULA	C20H30O3
MOLECULAR WEIGHT (Da)	318.4570
ACCURATE MASS (Da)	318.2195
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Penicillium
ORIGIN SPECIES	granulatum MCCC 3A00475
InChIKey	IXEKUSSTAAFIKN-FKBRWOSRSA-N
InChI	InChI=1S/C20H30O3/c1-11-9-15(21)12(2)20(11)6-5-13-14(20)10-18(3)7-8-19(4,16(13)18)17(22)23/h11-12,15-16,21H,5-10H2,1-4H3,(H,22,23)/t11-,12+,15-,16+,18-,19+,20-/m1/s1
SMILES	C[C@@H]1C[C@H]([C@@H]([C@@]12CCC3=C2C[C@@]4([C@H]3[C@@](CC4)(C)C(=O)O)C)C)O

ORIGINAL ISOLATION REFERENCE

CITATION	Niu, Siwen; Fan, Zuo-Wang; Xie, Chun-Lan; Liu, Qingmei; Luo, Zhu-Hua; Liu, Guangming; Yang, Xian-Wen Spirograterpene A, a Tetracyclic Spiro-Diterpene with a Fused 5/5/5/5 Ring System from the Deep-Sea-Derived Fungus Penicillium granulatum MCCC 3A00475 Journal of Natural Products 2017 80 (7) 2174-2177.
DOI	10.1021/acs.jnatprod.7b00475	PMID	28692272

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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