Novobiocin

CAS: 303-81-1

Ref. TR-N825320

Product Information

• Name: Novobiocin
• Synonyms: Benzamide, N-[7-[[3-O-(aminocarbonyl)-6-deoxy-5-C-methyl-4-O-methyl-α-L-lyxo-hexopyranosyl]oxy]-4-hydroxy-8-methyl-2-oxo-2H-1-benzopyran-3-yl]-4-hydroxy-3-(3-methyl-2-buten-1-yl)-, Benzamide, N-[7-[[3-O-(aminocarbonyl)-6-deoxy-5-C-methyl-4-O-methyl-α-L-lyxo-hexopyranosyl]oxy]-4-hydroxy-8-methyl-2-oxo-2H-1-benzopyran-3-yl]-4-hydroxy-3-(3-methyl-2-butenyl)- (9CI), Coumarin, 7-[4-(carbamoyloxy)tetrahydro-3-hydroxy-5-methoxy-6,6-dimethylpyran-2-yloxy]-4-hydroxy-3-[4-hydroxy-3-(3-methyl-2-butenyl)benzamido]-8-methyl- (6CI), Novobiocin (8CI), Albamix, Albamycin, Antibiotic PA-93, Cardelmycin, Cathocin, Cathomycin, Crystallinic acid, Inamycin, Novo-R, PA 93, Robiocina, Sirbiocina, Spheromycin, Stilbiocina, Streptonivicin
• Brand: TRC
• Description: Applications Novobiocin is an aminocoumarin antibiotic used in the treatment of Staphylococcus epidermis.References Lupescu, A. et al.: Cell. Phys. Biochem., 33, 670 (2014); Werner, M. et al.: Bioorg. Med. Chem., 22, 2176 (2014)

Chemical properties

• Molecular weight: 612.62
• Formula: C₃₁H₃₆N₂O₁₁
• Color/Form: Neat
• InChI: InChI=1S/C31H36N2O11/c1-14(2)7-8-16-13-17(9-11-19(16)34)27(37)33-21-22(35)18-10-12-20(15(3)24(18)42-28(21)38)41-29-23(36)25(43-30(32)39)26(40-6)31(4,5)44-29/h7,9-13,23,25-26,29,34-36H,8H2,1-6H3,(H2,32,39)(H,33,37)/t23-,25+,26-,29-/m1/s1
• InChI key: InChIKey=YJQPYGGHQPGBLI-CHGULSTCSA-N
• SMILES: CO[C@@H]1C(OC(N)=O)C(O)[C@H](Oc2ccc3c(O)c(NC(=O)c4ccc(O)c(CC=C(C)C)c4)c(=O)oc3c2C)OC1(C)C