Natural Products Atlas | Compounds

The Natural Products Atlas

Login

Compounds

COMPOUND NPA018454

STRUCTURE

Image structure

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

EXTERNAL LINKS

PROPERTIES

NPAID	NPA018454
CLUSTER ID	647
NODE ID	574
NAME	AT2433-A3
FORMULA	C33H33ClN4O9
MOLECULAR WEIGHT (Da)	665.0990
ACCURATE MASS (Da)	664.1936
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Actinomadura
ORIGIN SPECIES	melliaura ATCC 39691
InChIKey	ATEGCFWPRAJCNX-NVCNUFFYSA-N
InChI	InChI=1S/C33H33ClN4O9/c1-35-17-11-45-20(10-18(17)39)46-12-19-30(44-2)28(40)29(41)33(47-19)38-26-14(7-5-8-15(26)34)22-24-23(31(42)37-32(24)43)21-13-6-3-4-9-16(13)36-25(21)27(22)38/h3-9,17-20,28-30,33,35-36,39-41H,10-12H2,1-2H3,(H,37,42,43)/t17-,18-,19+,20-,28+,29+,30+,33+/m0/s1
SMILES	CN[C@H]1CO[C@H](C[C@@H]1O)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)N3C4=C(C=CC=C4Cl)C5=C6C(=C7C8=CC=CC=C8NC7=C53)C(=O)NC6=O)O)O)OC

ORIGINAL ISOLATION REFERENCE

CITATION	Shaaban, Khaled A.; Elshahawi, Sherif I.; Wang, Xiachang; Horn, Jamie; Kharel, Madan K.; Leggas, Markos; Thorson, Jon S. Cytotoxic Indolocarbazoles from Actinomadura melliaura ATCC 39691 Journal of Natural Products 2015 78 (7) 1723-1729.
DOI	10.1021/acs.jnatprod.5b00429	PMID	26091285

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Actinobacteria	LPSN	201174
Class	Actinobacteria	LPSN	-
Order	Streptosporangiales	LPSN	85012
Family	Thermomonosporaceae	LPSN	2012
Genus	Actinomadura	LPSN	1988

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