Natural Products Atlas | Compounds

The Natural Products Atlas

Login

Compounds

COMPOUND NPA008617

STRUCTURE

Image structure

EXPORT OPTIONS	PNG JSON SDF
PROJECT MOLECULE TO GLOBAL VIEW	See Global

EXTERNAL LINKS

PROPERTIES

NPAID	NPA008617
CLUSTER ID	873
NODE ID	755
NAME	Pretrichodermamide A
FORMULA	C20H22N2O9S2
MOLECULAR WEIGHT (Da)	498.5350
ACCURATE MASS (Da)	498.0767
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Trichoderma
ORIGIN SPECIES	sp. TPU199
InChIKey	PPQRKKLHNNMQJV-GHYZKQQQSA-N
InChI	InChI=1S/C20H22N2O9S2/c1-29-10-5-3-8(13(25)14(10)30-2)15-12-17(26)22-20(33-32-15,18(27)21-12)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(C(=C(C=C1)C2[C@@H]3C(=O)N4[C@@](C[C@@]5([C@@H](C=C[C@H]([C@@H]5O4)O)O)O)(C(=O)N3)SS2)O)OC

ORIGINAL ISOLATION REFERENCE

CITATION	Yamazaki, Hiroyuki; Rotinsulu, Henki; Narita, Reika; Takahashi, Ryosuke; Namikoshi, Michio Induced Production of Halogenated Epidithiodiketopiperazines by a Marine-Derived Trichoderma cf. brevicompactum with Sodium Halides Journal of Natural Products 2015 78 (10) 2319-2321.
DOI	10.1021/acs.jnatprod.5b00669	PMID	26439145

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

Show		Hide
DESCRIPTION	[[ getValue('description') ]]
KINGDOM	[[ getValue('kingdom') ]]
SUPER CLASS	[[ getValue('superclass') ]]
CLASS	[[ getValue('class') ]]
SUB CLASS	[[ getValue('subclass') ]]
MOLECULAR FRAMEWORK	[[ getValue('molecular_framework') ]]

NP CLASSIFIER

Show		Hide
SUPER CLASS	[[ getValue('superclass_results') ]]
CLASS	[[ getValue('class_results') ]]
PATHWAY	[[ getValue('pathway_results') ]]
IS GLYCOSIDE?	[[ getValue('isglycoside') ]]

If you encounter an issue on the website, please submit a bug report, feature request, or general issue through the issue tracker on GitHub.

Made with ♥ using Python

DB Version: 2024_09

Website Version: 3.0.2

Creative Commons License

The Natural Products Atlas is licensed under a Creative Commons Attribution-Noncommercial 4.0 International License.

Back to top of page