5WQ

Rifampin

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is present as a standalone ligand in 1 entries

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Chemical Component Summary
Name	Rifampin
Formula	C₄₃ H₆₄ N₄ O₁₁
Molecular Weight	812.988
Type	NON-POLYMER
Isomeric SMILES	CCOc1c(c(c2c3c1[C@@H](O/C=C\[C@H]([C@H]([C@H]([C@H]([C@@H]([C@H](C(=O)[C@@H](/C=C/C[C@@H](C(=O)Nc(c2O)c(c3)CNN4CCN(CC4)C)C)C)C)O)C)OC(=O)C)C)OC)O)O)C
InChI	InChI=1S/C43H64N4O11/c1-11-56-41-28(7)38(51)33-31-21-30(22-44-47-18-16-46(9)17-19-47)35(39(33)52)45-42(53)24(3)14-12-13-23(2)36(49)26(5)37(50)27(6)40(58-29(8)48)25(4)32(55-10)15-20-57-43(54)34(31)41/h12-13,15,20-21,23-27,32,37,40,43-44,50-52,54H,11,14,16-19,22H2,1-10H3,(H,45,53)/b13-12+,20-15-/t23-,24+,25-,26+,27+,32-,37-,40-,43-/m1/s1
InChIKey	GKIQTWBZJKGLKG-FVKVYWJVSA-N

Chemical Details
Formal Charge	0
Atom Count	122
Chiral Atom Count	9
Bond Count	125
Aromatic Bond Count	11

Related Resource References

Resource Name	Reference
PubChem	102515543

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.