Natural Products Atlas | Compounds

The Natural Products Atlas

Login

Compounds

COMPOUND NPA005417

STRUCTURE

Image structure

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

EXTERNAL LINKS

PROPERTIES

NPAID	NPA005417
CLUSTER ID	2666
NODE ID	1255
NAME	Pestalotheol A
FORMULA	C16H24O6
MOLECULAR WEIGHT (Da)	312.3620
ACCURATE MASS (Da)	312.1573
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Pestalotiopsis
ORIGIN SPECIES	theae
InChIKey	KHFKITMXZQEMRU-DZJQYVJYSA-N
InChI	InChI=1S/C16H24O6/c1-14(2)6-9(17)8-5-10-16(20,13(18)12(8)22-14)7-11(21-10)15(3,4)19/h10-11,13,18-20H,5-7H2,1-4H3/t10-,11+,13-,16-/m0/s1
SMILES	CC1(CC(=O)C2=C(O1)[C@@H]([C@@]3(C[C@@H](O[C@H]3C2)C(C)(C)O)O)O)C

ORIGINAL ISOLATION REFERENCE

CITATION	Li, Erwei; Tian, Renrong; Liu, Shuchun; Chen, Xulin; Guo, Liangdong; Che, Yongsheng Pestalotheols A-D, bioactive metabolites from the plant endophytic fungus Pestalotiopsis theae Journal of Natural Products 2008 71 (4) 664-668.
DOI	10.1021/np700744t	PMID	18303847

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Sordariomycetes	MycoBank	147550
Order	Amphisphaeriales	MycoBank	-
Family	Sporocadaceae	MycoBank	1812776
Genus	Pestalotiopsis	MycoBank	37840

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