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Compounds

COMPOUND NPA007810

STRUCTURE

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PROPERTIES

NPAID	NPA007810
CLUSTER ID	17
NODE ID	17
NAME	Sulpinine C
FORMULA	C32H41NO6
MOLECULAR WEIGHT (Da)	535.6810
ACCURATE MASS (Da)	535.2934
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Aspergillus
ORIGIN SPECIES	sulphureus
InChIKey	VOYIMRFVBGSBTG-SBRCDQMXSA-N
InChI	InChI=1S/C32H41NO6/c1-8-28(4,5)18-9-10-20-21(15-18)33-27(36)30(7)19(16-22(20)34)11-14-31(37)29(30,6)13-12-23-32(31)26(39-32)24(35)25(38-23)17(2)3/h8-10,15,19,23-26,35,37H,1-2,11-14,16H2,3-7H3,(H,33,36)/t19-,23-,24-,25+,26+,29+,30+,31-,32-/m0/s1
SMILES	CC(=C)[C@@H]1[C@@H]([C@@H]2[C@@]3(O2)[C@@H](O1)CC[C@]4([C@]3(CC[C@@H]5[C@@]4(C(=O)NC6=C(C=CC(=C6)C(C)(C)C=C)C(=O)C5)C)O)C)O

ORIGINAL ISOLATION REFERENCE

CITATION	Laakso, Jodi A.; Gloer, James B.; Wicklow, Donald T.; Dowd, Patrick F. Sulpinines A-C and Secopenitrem B: New Antiinsectan Metabolites from the Sclerotia of Aspergillus sulphureus Journal of Organic Chemistry 1992 57 (7) 2066-2071.
DOI	10.1021/jo00033a030	PMID	-

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	Aspergillus	MycoBank	5052

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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