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Compounds

COMPOUND NPA013276

STRUCTURE

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PROPERTIES

NPAID	NPA013276
CLUSTER ID	4496
NODE ID	3288
NAME	CT2108A
FORMULA	C21H22O7
MOLECULAR WEIGHT (Da)	386.4000
ACCURATE MASS (Da)	386.1366
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Penicillium
ORIGIN SPECIES	solitum (Westling) strain CT2108
InChIKey	DHOBWLDZMMCUPR-QBINLZOGSA-N
InChI	InChI=1S/C21H22O7/c1-4-5-6-7-8-9-15-11-14-12-16(23)20(3,27-17(24)10-13(2)22)18(25)21(14)19(26-15)28-21/h4-9,11-13,19,22H,10H2,1-3H3/b5-4+,7-6+,9-8+/t13-,19?,20-,21?/m0/s1
SMILES	C/C=C/C=C/C=C/C1=CC2=CC(=O)[C@](C(=O)C23C(O1)O3)(C)OC(=O)C[C@H](C)O

ORIGINAL ISOLATION REFERENCE

CITATION	Laakso, Jodi A.; Raulli, Robert; McElhaney-Feser, Gail E.; Actor, Paul; Underiner, Ted L.; Hotovec, Brian J.; Mocek, Ursula; Cihlar, Ronald L.; Broedel Jr., Sheldon E. CT2108A and B: New fatty acid synthase inhibitors as antifungal agents Journal of Natural Products 2003 66 (8) 1041-1046.
DOI	10.1021/np030046g	PMID	12932120

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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