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Compounds

COMPOUND NPA008884

STRUCTURE

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PROPERTIES

NPAID	NPA008884
CLUSTER ID	375
NODE ID	339
NAME	Brevione C
FORMULA	C27H32O4
MOLECULAR WEIGHT (Da)	420.5490
ACCURATE MASS (Da)	420.2301
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Penicillium
ORIGIN SPECIES	brevicompactum Dierckx
InChIKey	YIMHQYHZZQFOJT-YFSQZJJESA-N
InChI	InChI=1S/C27H32O4/c1-15-13-19(28)9-11-25(5)21(15)10-12-26(6)22(25)8-7-16(2)27(26)14-20-23(31-27)17(3)18(4)30-24(20)29/h7,9,11,13,21-22H,8,10,12,14H2,1-6H3/t21-,22+,25-,26+,27-/m1/s1
SMILES	CC1=CC[C@@H]2[C@@]([C@@]13CC4=C(O3)C(=C(OC4=O)C)C)(CC[C@H]5[C@]2(C=CC(=O)C=C5C)C)C

ORIGINAL ISOLATION REFERENCE

CITATION	Macias; Varela; Simonet; Cutler; Dugan; Hill Novel bioactive breviane spiroditerpenoids from Penicillium brevicompactum Dierckx Journal of Organic Chemistry 2000 65 (26) 9039-9046.
DOI	10.1021/jo0011078	PMID	11149849

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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