3-(1-Iminomethyl-1,4-diazabicyclo(4.4.0)decyl)rifamycin SV

Molecular Formula: C46H62N4O12


InChI: InChI=1/C46H62N4O12/c1-23-13-12-14-24(2)45(58)48-36-31(21-47-50-19-18-49-17-11-10-15-30(49)22-50)40(55)33-34(41(36)56)39(54)28(6)43-35(33)44(57)46(8,62-43)60-20-16-32(59-9)25(3)42(61-29(7)51)27(5)38(53)26(4)37(23)52/h12-14,16,20-21,23,25-27,30,32,37-38,42,47,52-54,56H,10-11,15,17-19,22H2,1-9H3,(H,48,58)/b13-12+,20-16+,24-14+,31-21+/t23-,25+,26+,27+,30u,32-,37-,38+,42+,46-/m0/s1/f/h48H

InChIKey: InChIKey=LJPBWUPAOLVYEJ-FRWAVNIGDY
SMILES: CC1C=CC=C(C(=O)NC2=C(C3=C(C(=C4C(=C3C(=O)C2=CNN5CCN6CCCCC6C5)C(=O)C(O4)(OC=CC(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C)O)O)C

Names:
    CGP 27557 (9CI)
    Cgp 27557
    Rifamycin SV, 3-((1,4-diazabicyclo(4.4.0)decyl)iminomethyl)-
    122188-45-8
    3-(1-Iminomethyl-1,4-diazabicyclo(4.4.0)decyl)rifamycin SV

Registries:
    PubChem CID 6436201
    PubChem ID 214750