Bulgecin A
[CAS# 92953-54-3]

Identification

• Name: Bulgecin A
• Synonyms: 2-[[4-[3-Acetamido-4-Hydroxy-6-(Hydroxymethyl)-5-Sulfooxy-Tetrahydropyran-2-Yl]Oxy-5-(Hydroxymethyl)Pyrrolidine-2-Carbonyl]Amino]Ethanesulfonic Acid; 2-[[[4-[[3-Acetamido-4-Hydroxy-6-(Hydroxymethyl)-5-Sulfooxy-2-Tetrahydropyranyl]Oxy]-5-(Hydroxymethyl)-2-P
• Molecular Formula: C₁₆H₂₉N₃O₁₄S₂
• Molecular Weight: 551.54
• CAS Registry Number: 92953-54-3
• SMILES: C(C[S](=O)(=O)O)NC(C1CC(C(CO)N1)OC2C(C(C(C(CO)O2)O[S](=O)(=O)O)O)NC(C)=O)=O
• InChI: 1S/C16H29N3O14S2/c1-7(22)18-12-13(23)14(33-35(28,29)30)11(6-21)32-16(12)31-10-4-8(19-9(10)5-20)15(24)17-2-3-34(25,26)27/h8-14,16,19-21,23H,2-6H2,1H3,(H,17,24)(H,18,22)(H,25,26,27)(H,28,29,30)
• InChIKey: RPNZWZDLNYCCIG-UHFFFAOYSA-N

Properties

• Density: 1.728g/cm³ (Cal.)