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Compounds

COMPOUND NPA012359

STRUCTURE

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PROPERTIES

NPAID	NPA012359
CLUSTER ID	280
NODE ID	254
NAME	Verticillin E
FORMULA	C32H28N6O8S4
MOLECULAR WEIGHT (Da)	752.8780
ACCURATE MASS (Da)	752.0851
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Gliocladium
ORIGIN SPECIES	catenulatum
InChIKey	NZMULNGUSBQWIQ-WRXCQDLESA-N
InChI	InChI=1S/C32H28N6O8S4/c1-13(39)29-25(45)37-21-27(15-9-5-7-11-17(15)33-21,19(41)31(37,49-47-29)23(43)35(29)3)28-16-10-6-8-12-18(16)34-22(28)38-26(46)30(14(2)40)36(4)24(44)32(38,20(28)42)50-48-30/h5-12,19-22,33-34,41-42H,1-4H3/t19-,20-,21+,22+,27+,28+,29-,30-,31-,32-/m0/s1
SMILES	CC(=O)[C@]12C(=O)N3[C@@H]4[C@]([C@@H]([C@@]3(C(=O)N1C)SS2)O)(C5=CC=CC=C5N4)[C@]67[C@@H]([C@]89C(=O)N([C@](C(=O)N8[C@H]6NC1=CC=CC=C71)(SS9)C(=O)C)C)O

ORIGINAL ISOLATION REFERENCE

CITATION	Joshi, Biren K.; Gloer, James B.; Wicklow, Donald T. New verticillin and glisoprenin analogues from Gliocladium catenulatum, a mycoparasite of Aspergillus flavus sclerotia Journal of Natural Products 1999 62 (5) 730-733.
DOI	10.1021/np980530x	PMID	10346956

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Sordariomycetes	MycoBank	147550
Order	Hypocreales	MycoBank	5125
Family	Hypocreaceae	MycoBank	5129
Genus	Gliocladium	MycoBank	62887

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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