3-[[(3-Phenylpropoxy)Imino]Methyl]-Rifamycin
[CAS# 38128-87-9]

Identification

• Name: 3-[[(3-Phenylpropoxy)Imino]Methyl]-Rifamycin
• Synonyms: 3-Formylrifamycin Sv O-(3-Phenylpropyl)Oxime; Brn 5418748; Nsc 143476
• Molecular Formula: C₄₇H₅₈N₂O₁₃
• Molecular Weight: 858.98
• CAS Registry Number: 38128-87-9
• SMILES: [C@H]1([C@H](O)[C@@H]([C@@H](O)[C@@H](C)\C=C\C=C(C(=O)NC4=C(O)C3=C(C2=C(O[C@](O/C=C/[C@H](OC)[C@H]([C@H]1OC(=O)C)C)(C2=O)C)C(=C3O)C)C(=O)\C4=C\NOCCCC5=CC=CC=C5)\C)C)C
• InChI: 1S/C47H58N2O13/c1-24-15-13-16-25(2)46(57)49-37-32(23-48-60-21-14-19-31-17-11-10-12-18-31)41(54)34-35(42(37)55)40(53)29(6)44-36(34)45(56)47(8,62-44)59-22-20-33(58-9)26(3)43(61-30(7)50)28(5)39(52)27(4)38(24)51/h10-13,15-18,20,22-24,26-28,33,38-39,43,48,51-53,55H,14,19,21H2,1-9H3,(H,49,57)/b15-13+,22-20+,25-16-,32-23+/t24-,26+,27+,28+,33-,38-,39+,43+,47-/m0/s1
• InChIKey: ZPBNOWWJKRKBEV-YZMZVZPOSA-N