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Compounds

COMPOUND NPA020224

STRUCTURE

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PROJECT MOLECULE TO GLOBAL VIEW	See Global

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PROPERTIES

NPAID	NPA020224
CLUSTER ID	57
NODE ID	53
NAME	Not named
FORMULA	C28H35NO4
MOLECULAR WEIGHT (Da)	449.5910
ACCURATE MASS (Da)	449.2566
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Cordyceps
ORIGIN SPECIES	taii
InChIKey	TUOTYDFTSBXZFM-QHLNMVOJSA-N
InChI	InChI=1S/C28H35NO4/c1-17-9-8-12-21-15-18(2)19(3)24-22(16-20-10-6-5-7-11-20)29-26(32)28(21,24)23(30)13-14-27(4,33)25(17)31/h5-8,10-15,17,19,21-24,30,33H,9,16H2,1-4H3,(H,29,32)/b12-8+,14-13+/t17-,19-,21-,22+,23+,24-,27+,28?/m0/s1
SMILES	C[C@H]1C/C=C/[C@H]2C=C([C@@H]([C@@H]3C2([C@@H](/C=C/[C@@](C1=O)(C)O)O)C(=O)N[C@@H]3CC4=CC=CC=C4)C)C

ORIGINAL ISOLATION REFERENCE

CITATION	Li, Xiao-Gang; Pan, Wei-Dong; Lou, Hua-Yong; Liu, Ru-Ming; Xiao, Jian-Hui; Zhong, Jian-Jiang New cytochalasins from medicinal macrofungus Crodyceps taii and their inhibitory activities against human cancer cells Bioorganic and Medicinal Chemistry Letters 2015 25 (9) 1823-1826.
DOI	10.1016/j.bmcl.2015.03.059	PMID	25863432

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	Cordycipitaceae	MycoBank	474943
Genus	Cordyceps	MycoBank	45234

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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