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Compounds

COMPOUND NPA029155

STRUCTURE

Image structure

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PROJECT MOLECULE TO GLOBAL VIEW	See Global

EXTERNAL LINKS

PROPERTIES

NPAID	NPA029155
CLUSTER ID	873
NODE ID	755
NAME	5-epi-trithiopretrichodermamide A
FORMULA	C20H22N2O9S3
MOLECULAR WEIGHT (Da)	530.6020
ACCURATE MASS (Da)	530.0487
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Trichoderma
ORIGIN SPECIES	sp. TPU199
InChIKey	KKLSQYHUVIECRV-GGLVFAGASA-N
InChI	InChI=1S/C20H22N2O9S3/c1-29-10-5-3-8(13(25)14(10)30-2)15-12-17(26)22-20(18(27)21-12,33-34-32-15)7-19(28)11(24)6-4-9(23)16(19)31-22/h3-6,9,11-12,15-16,23-25,28H,7H2,1-2H3,(H,21,27)/t9-,11+,12-,15-,16+,19+,20-/m1/s1
SMILES	COC1=C(OC)C(O)=C([C@H]2SSS[C@@]34C[C@]5(O)[C@@H](O)C=C[C@@H](O)[C@@H]5ON3C(=O)[C@@H]2NC4=O)C=C1

ORIGINAL ISOLATION REFERENCE

CITATION	Bunya, Yuki; Kirikoshi, Ryota; Namikoshi, Michio; Ogasawara, Teruki; Rotinsulu, Henki; Takahashi, Ohgi; Uchida, Ryuji; Yagi, Akiho; Yamazaki, Hiroyuki Epipolythiodiketopiperazine and trichothecene derivatives from the NaI-containing fermentation of marine-derived Trichoderma cf. brevicompactum Journal of Antibiotics 2020 73 559-567.
DOI	10.1038/s41429-020-0314-5	PMID	32427947

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	Hypocreaceae	MycoBank	5129
Genus	Trichoderma	MycoBank	5543

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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