Natural Products Atlas | Compounds

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Compounds

ID	Spectrum Quality	Annotated Name
CCMSLIB00004689503	Gold	3
CCMSLIB00004689504	Gold	3
CCMSLIB00004716157	Gold	3
CCMSLIB00004716150	Gold	3
CCMSLIB00004716151	Gold	3
CCMSLIB00004716152	Gold	3
CCMSLIB00004716153	Gold	3
CCMSLIB00004716154	Gold	3
CCMSLIB00004716155	Gold	3
CCMSLIB00004716156	Gold	3
CCMSLIB00004716158	Gold	3
CCMSLIB00004716159	Gold	3
CCMSLIB00004716160	Gold	3
CCMSLIB00004716161	Gold	3
CCMSLIB00004716162	Gold	3
CCMSLIB00004716163	Gold	3
CCMSLIB00004716164	Gold	3
CCMSLIB00000847532	Gold	1
CCMSLIB00005723175	Gold	3
CCMSLIB00005723176	Gold	3
CCMSLIB00012131978	Gold	4
CCMSLIB00012131976	Gold	4
CCMSLIB00012131977	Gold	4
CCMSLIB00012131979	Gold	4
CCMSLIB00009971775	Gold	4
CCMSLIB00009971773	Gold	4
CCMSLIB00009971774	Gold	4
CCMSLIB00009971776	Gold	4
CCMSLIB00012131980	Gold	4
CCMSLIB00009971777	Gold	4

COMPOUND NPA010389

STRUCTURE

Image structure

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PROJECT MOLECULE TO GLOBAL VIEW	See Global

EXTERNAL LINKS

PROPERTIES

NPAID	NPA010389
CLUSTER ID	4157
NODE ID	3086
NAME	Tyroscherin
FORMULA	C21H35NO2
MOLECULAR WEIGHT (Da)	333.5160
ACCURATE MASS (Da)	333.2668
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Pseudallescheria
ORIGIN SPECIES	sp.
InChIKey	RNCWKUCWPBNWOH-XAPSYRGFSA-N
InChI	InChI=1S/C21H35NO2/c1-5-16(2)14-17(3)8-6-7-9-21(24)20(22-4)15-18-10-12-19(23)13-11-18/h6,8,10-13,16-17,20-24H,5,7,9,14-15H2,1-4H3/b8-6+/t16-,17+,20+,21-/m1/s1
SMILES	CC[C@@H](C)C[C@@H](C)/C=C/CC[C@@H](O)[C@H](CC1=CC=C(O)C=C1)NC

ORIGINAL ISOLATION REFERENCE

CITATION	Hayakawa, Yoichi; Yamashita, Tomoki; Mori, Toshiya; Nagai, Koji; Shin-Ya, Kazuo; Watanabe, Hidenori Structure of tyroscherin, an antitumor antibiotic against IGF-1-dependent Cells from Pseudallescheria sp Journal of Antibiotics 2004 57 (10) 634-638.
DOI	10.7164/antibiotics.57.634	PMID	15638323

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Sordariomycetes	MycoBank	147550
Order	Microascales	MycoBank	5592
Family	Microascaceae	MycoBank	5593
Genus	Pseudallescheria	MycoBank	5596

SYNTHESES

CITATION 1	Tae HS; Hines J; Schneekloth AR; Crews CM Total synthesis and biological evaluation of tyroscherin. Organic Letters 2010 12 (19) 4308-11. DOI: 10.1021/ol101801u PMID: 20831175

REVISIONS

VERSION	SMILES	CITATION
Original Isolation	CC[C@H](C)C[C@H](C)/C=C/CC[C@@H](O)[C@@H](CC1=CC=C(O)C=C1)NC	Hayakawa, Yoichi; Yamashita, Tomoki; Mori, Toshiya; Nagai, Koji; Shin-Ya, Kazuo; Watanabe, Hidenori Structure of tyroscherin, an antitumor antibiotic against IGF-1-dependent Cells from Pseudallescheria sp Journal of Antibiotics 2004 57 (10) 634-638. DOI: 10.7164/antibiotics.57.634 PMID: 15638323
2	CC[C@@H](C)C[C@@H](C)/C=C/CC[C@@H](O)[C@H](CC1=CC=C(O)C=C1)NC	Katsuta, Ryo; Shibata, Chié; Ishigami, Ken; Watanabe, Hidenori; Kitahara, Takeshi Synthesis and structure revision of tyroscherin, a growth inhibitor of IGF-1-dependent tumor cells Tetrahedron Letters 2008 49 (49) 7042-7045. DOI: 10.1016/j.tetlet.2008.09.141

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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