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Compounds

COMPOUND NPA014410

STRUCTURE

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PROPERTIES

NPAID	NPA014410
CLUSTER ID	57
NODE ID	53
NAME	(11)-Cytochalasa-5,13,19-triene-l,21-dione-7-hydroperoxy-17-hydroxy-16,18-dimethyl-10-phenyl-(5Z,7S,13E,16S,17R,18S*,19E)
FORMULA	C28H35NO5
MOLECULAR WEIGHT (Da)	465.5900
ACCURATE MASS (Da)	465.2515
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Daldinia
ORIGIN SPECIES	sp.
InChIKey	YZMKUCUMIIGSIT-BPPJWCPBSA-N
InChI	InChI=1S/C28H35NO5/c1-16-9-8-12-21-26(34-33)19(4)18(3)24-22(15-20-10-6-5-7-11-20)29-27(32)28(21,24)23(30)14-13-17(2)25(16)31/h5-8,10-14,16-17,21-22,24-26,31,33H,9,15H2,1-4H3,(H,29,32)/b12-8+,14-13+/t16-,17-,21-,22-,24-,25+,26+,28+/m1/s1
SMILES	C[C@@H]1C/C=C/[C@@H]2[C@H](C(=C([C@H]3[C@]2(C(=O)/C=C/[C@H]([C@H]1O)C)C(=O)N[C@@H]3CC4=CC=CC=C4)C)C)OO

ORIGINAL ISOLATION REFERENCE

CITATION	Buchanan, Malcolm S.; Hashimoto, Toshihiro; Asakawa, Yoshinori Cytochalasins from a Daldinia sp. of fungus Phytochemistry 1996 41 (3) 821-828.
DOI	10.1016/0031-9422(95)00644-3	PMID	-

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Sordariomycetes	MycoBank	147550
Order	Xylariales	MycoBank	37989
Family	Hypoxylaceae	MycoBank	2033035
Genus	Daldinia	MycoBank	42360

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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