Darobactin information

Darobactin
Identifiers
3D model (JSmol)	Interactive image;
PubChem CID	154586077;
	InChI InChI=1S/C47H55N11O12/c48-13-5-9-25-23-11-12-30-27(15-23)28(19-51-30)40-39(58-42(63)31(17-36(50)61)53-41(62)29(49)16-24-18-52-37-26(24)8-4-10-35(37)70-40)46(67)56-34(21-60)44(65)57-38(25)45(66)55-33(20-59)43(64)54-32(47(68)69)14-22-6-2-1-3-7-22/h1-4,6-8,10-12,15,18-19,25,29,31-34,38-40,51-52,59-60H,5,9,13-14,16-17,20-21,48-49H2,(H2,50,61)(H,53,62)(H,54,64)(H,55,66)(H,56,67)(H,57,65)(H,58,63)(H,68,69)/t25-,29-,31-,32-,33-,34-,38-,39-,40+/m0/s1 Key: IAOIRKWNLBCFFO-KUDSBEMESA-N;
	SMILES NCCC[C@@H]1[C@H](NC(=O)[C@H](CO)NC(=O)[C@H]2NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CC3=CNC4=C3C=CC=C4O[C@@H]2C2=CNC3=CC=C1C=C23)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O;
Properties
Chemical formula	C47H55N11O12
Molar mass	966.022 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

Darobactin is an experimental antibiotic compound that may be effective against Gram-negative bacteria. If it can be developed into a human-compatible form it would be the first to come from an animal microbiome.^[1]

^ Nield, David (24 November 2019). "A Tiny Worm Has Been Found Carrying New Antibiotic That Could Help Us Fight Superbugs". ScienceAlert. Archived from the original on 2019-11-25. Retrieved 2019-11-26.

[:0-1] Nield, David (24 November 2019). "A Tiny Worm Has Been Found Carrying New Antibiotic That Could Help Us Fight Superbugs". ScienceAlert. Archived from the original on 2019-11-25. Retrieved 2019-11-26.

Darobactin information

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Darobactin

Radical SAM

Identifiers

3D model (JSmol)	Interactive image
PubChem CID	154586077
InChI InChI=1S/C47H55N11O12/c48-13-5-9-25-23-11-12-30-27(15-23)28(19-51-30)40-39(58-42(63)31(17-36(50)61)53-41(62)29(49)16-24-18-52-37-26(24)8-4-10-35(37)70-40)46(67)56-34(21-60)44(65)57-38(25)45(66)55-33(20-59)43(64)54-32(47(68)69)14-22-6-2-1-3-7-22/h1-4,6-8,10-12,15,18-19,25,29,31-34,38-40,51-52,59-60H,5,9,13-14,16-17,20-21,48-49H2,(H2,50,61)(H,53,62)(H,54,64)(H,55,66)(H,56,67)(H,57,65)(H,58,63)(H,68,69)/t25-,29-,31-,32-,33-,34-,38-,39-,40+/m0/s1 Key: IAOIRKWNLBCFFO-KUDSBEMESA-N
SMILES NCCC[C@@H]1[C@H](NC(=O)[C@H](CO)NC(=O)[C@H]2NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CC3=CNC4=C3C=CC=C4O[C@@H]2C2=CNC3=CC=C1C=C23)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
Properties
Chemical formula	C₄₇H₅₅N₁₁O₁₂
Molar mass	966.022 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