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Compounds

COMPOUND NPA023922

STRUCTURE

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PROPERTIES

NPAID	NPA023922
CLUSTER ID	260
NODE ID	237
NAME	Chetomin A
FORMULA	C31H30N6O6S6
MOLECULAR WEIGHT (Da)	775.0190
ACCURATE MASS (Da)	774.0551
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Chaetomium
ORIGIN SPECIES	cochliodes
InChIKey	DVPMWXWNYJCZHY-NOUXEJRGSA-N
InChI	InChI=1S/C31H30N6O6S6/c1-33-25(42)30(15-38)34(2)23(40)28(33,46-48-49-47-30)12-17-13-36(21-11-7-4-8-18(17)21)27-14-29-24(41)35(3)31(16-39,45-44-29)26(43)37(29)22(27)32-20-10-6-5-9-19(20)27/h4-11,13,22,32,38-39H,12,14-16H2,1-3H3/t22-,27+,28-,29-,30-,31-/m1/s1
SMILES	CN1C(=O)[C@@]2(N(C(=O)[C@]1(SSSS2)CC3=CN(C4=CC=CC=C43)[C@]56C[C@@]78C(=O)N([C@@](C(=O)N7[C@H]5NC9=CC=CC=C69)(SS8)CO)C)C)CO

ORIGINAL ISOLATION REFERENCE

CITATION	Wang, Meng-Hua; Hu, You-Cai; Sun, Bing-Da; Yu, Meng; Niu, Shu-Bin; Guo, Zhe; Zhang, Xiao-Yan; Zhang, Tao; Ding, Gang; Zou, Zhong-Mei Highly photosensitive poly-sulfur-bridged chetomin analogues from chaetomium cochliodes Organic Letters 2018 20 (7) 1806-1809.
DOI	10.1021/acs.orglett.8b00304	PMID	29537276

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Sordariomycetes	MycoBank	147550
Order	Sordariales	MycoBank	5139
Family	Chaetomiaceae	MycoBank	35718
Genus	Chaetomium	MycoBank	5149

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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