Bacillibactin information

Bacillibactin
Names
	Preferred IUPAC name N,N′,N′′-{[(2R,3S,6R,7S,10R,11S)-2,6,10-Trimethyl-4,8,12-trioxo-1,5,9-trioxacyclododecane-3,7,11-triyl]tris[azanediyl(2-oxoethane-2,1-diyl)]}tris(2,3-dihydroxybenzamide)
	Other names Corynebactin
Identifiers
CAS Number	95536-41-7;
3D model (JSmol)	Interactive image;
ChemSpider	111553;
PubChem CID	125349;
UNII	36PG6K45CP ;
CompTox Dashboard (EPA)	DTXSID101045559 ;
	InChI InChI=1S/C39H42N6O18/c1-16-28(43-25(49)13-40-34(55)19-7-4-10-22(46)31(19)52)37(58)62-18(3)30(45-27(51)15-42-36(57)21-9-6-12-24(48)33(21)54)39(60)63-17(2)29(38(59)61-16)44-26(50)14-41-35(56)20-8-5-11-23(47)32(20)53/h4-12,16-18,28-30,46-48,52-54H,13-15H2,1-3H3,(H,40,55)(H,41,56)(H,42,57)(H,43,49)(H,44,50)(H,45,51)/t16-,17-,18-,28+,29+,30+/m1/s1 Key: RCQTVEFBFUNTGM-BDVHUIKKSA-N; InChI=1/C39H42N6O18/c1-16-28(43-25(49)13-40-34(55)19-7-4-10-22(46)31(19)52)37(58)62-18(3)30(45-27(51)15-42-36(57)21-9-6-12-24(48)33(21)54)39(60)63-17(2)29(38(59)61-16)44-26(50)14-41-35(56)20-8-5-11-23(47)32(20)53/h4-12,16-18,28-30,46-48,52-54H,13-15H2,1-3H3,(H,40,55)(H,41,56)(H,42,57)(H,43,49)(H,44,50)(H,45,51)/t16-,17-,18-,28+,29+,30+/m1/s1 Key: RCQTVEFBFUNTGM-BDVHUIKKBO;
	SMILES C[C@@H]1[C@@H](C(=O)O[C@@H]([C@@H](C(=O)O[C@@H]([C@@H](C(=O)O1)NC(=O)CNC(=O)c2cccc(c2O)O)C)NC(=O)CNC(=O)c3cccc(c3O)O)C)NC(=O)CNC(=O)c4cccc(c4O)O;
Properties
Chemical formula	C39H42N6O18
Molar mass	882.789 g·mol−1
	Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa). Infobox references

Bacillibactin is a catechol-based siderophore secreted by members of the genus Bacillus, including Bacillus anthracis and Bacillus subtilis. It is involved in the chelation of ferric iron (Fe³⁺) from the surrounding environment and is subsequently transferred into the bacterial cytoplasm via the use of ABC transporters.^[1]

^ Hotta, K; Kim, CY; Fox, DT; Koppisch, AT (July 2010). "Siderophore-mediated iron acquisition in Bacillus anthracis and related strains". Microbiology. 156 (Pt 7): 1918–25. doi:10.1099/mic.0.039404-0. PMID 20466767.

[1] Hotta, K; Kim, CY; Fox, DT; Koppisch, AT (July 2010). "Siderophore-mediated iron acquisition in Bacillus anthracis and related strains". Microbiology. 156 (Pt 7): 1918–25. doi:10.1099/mic.0.039404-0. PMID 20466767.

Bacillibactin information

and 7 Related for: Bacillibactin information

Bacillibactin

Siderophore

Enterobactin

Ken Raymond

Rebecca Abergel

FepA

Siderocalin