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Compounds

COMPOUND NPA024766

STRUCTURE

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PROPERTIES

NPAID	NPA024766
CLUSTER ID	1191
NODE ID	1013
NAME	Cryptosporioptide C
FORMULA	C40H38O18
MOLECULAR WEIGHT (Da)	806.7260
ACCURATE MASS (Da)	806.2058
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Cryptosporiopsis
ORIGIN SPECIES	sp. 8999
InChIKey	TZUKFMFVOAIXGN-GNSYCBAESA-N
InChI	InChI=1S/C40H38O18/c1-7-13(31(47)48)33(51)53-35-37(3)21(27(45)29-39(35,5)57-29)25(43)19-17(55-37)11-9-15(23(19)41)16-10-12-18-20(24(16)42)26(44)22-28(46)30-40(6,58-30)36(38(22,4)56-18)54-34(52)14(8-2)32(49)50/h9-14,29-30,35-36,41-44H,7-8H2,1-6H3,(H,47,48)(H,49,50)/t13?,14?,29-,30-,35+,36+,37+,38+,39-,40-/m0/s1
SMILES	CCC(C(=O)O)C(=O)O[C@H]1[C@@]2([C@@H](O2)C(=O)C3=C(C4=C(C=CC(=C4O)C5=C(C6=C(C=C5)O[C@]7([C@H]([C@@]8([C@@H](O8)C(=O)C7=C6O)C)OC(=O)C(CC)C(=O)O)C)O)O[C@@]13C)O)C

ORIGINAL ISOLATION REFERENCE

CITATION	Greco C; de Mattos-Shipley K; Bailey AM; Mulholland NP; Vincent JL; Willis CL; Cox RJ; Simpson TJ Structure revision of cryptosporioptides and determination of the genetic basis for dimeric xanthone biosynthesis in fungi. Chemical Science 2019 10 (10) 2930-2939.
DOI	10.1039/c8sc05126g	PMID	30996871

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Leotiomycetes	MycoBank	147548
Order	Helotiales	MycoBank	5178
Family	Dermateaceae	MycoBank	76657
Genus	Cryptosporiopsis	MycoBank	108533

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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