Natural Products Atlas | Compounds

The Natural Products Atlas

Login

Compounds

COMPOUND NPA032839

STRUCTURE

Image structure

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

EXTERNAL LINKS

PROPERTIES

NPAID	NPA032839
CLUSTER ID	4848
NODE ID	3270
NAME	Thiostreptamide S4
FORMULA	C60H93N14O11S6+
MOLECULAR WEIGHT (Da)	1378.8930
ACCURATE MASS (Da)	1377.5467
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	sp. NRRL S-4
InChIKey	AKETULXCBSMUTF-MYXRQXSUSA-O
InChI	InChI=1S/C60H92N14O11S6/c1-17-31(6)45(72-57(86)35(10)63-49(77)33(8)64-58(87)40(22-24-90-16)67-59(88)44(30(4)5)69-52(80)36(11)75)60(89)65-34(9)51(79)70-46-37(12)91-25-23-61-54(82)47(48(76)42-27-73(13)28-74(42)14)71-53(81)41(26-38-18-20-39(85-15)21-19-38)66-50(78)32(7)62-55(83)43(29(2)3)68-56(46)84/h18-21,23,25,27-35,37,40-41,43-48,76H,17,22,24,26H2,1-16H3,(H11-,61,62,63,64,65,66,67,68,69,70,71,72,77,78,79,80,81,82,83,84,86,87,88,89)/p+1/t31?,32-,33-,34-,35-,37+,40-,41-,43-,44-,45-,46-,47-,48?/m0/s1
SMILES	CCC(C)[C@H](NC(=S)[C@H](C)NC(=O)[C@H](C)NC(=S)[C@H](CCSC)NC(=S)[C@@H](NC(=O)C(C)=O)C(C)C)C(=S)N[C@@H](C)C(=O)N[C@@H]1C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC2=CC=C(OC)C=C2)C(=O)N[C@@H](C(O)C2=C[N+](C)=CN2C)C(=O)NC=CS[C@@H]1C

ORIGINAL ISOLATION REFERENCE

CITATION	Frattaruolo, Luca; Lacret, Rodney; Cappello, Anna Rita; Truman, Andrew W. A Genomics-Based Approach Identifies a Thioviridamide-Like Compound with Selective Anticancer Activity ACS Chemical Biology 2017 12 (11) 2815-2822.
DOI	10.1021/acschembio.7b00677	PMID	28968491

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Actinobacteria	LPSN	201174
Class	Actinobacteria	LPSN	-
Order	Streptomycetales	LPSN	85011
Family	Streptomycetaceae	LPSN	2062
Genus	Streptomyces	LPSN	1883

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