MOTUPORIN

Molecular Formula: C40H63N5O10


InChI: InChI=1/C40H63N5O10/c1-10-30-37(49)44-34(40(53)54)26(7)36(48)43-33(22(2)3)38(50)41-28(25(6)35(47)42-29(39(51)52)18-19-32(46)45(30)8)17-16-23(4)20-24(5)31(55-9)21-27-14-12-11-13-15-27/h11-15,22-26,28-31,33-34H,10,16-21H2,1-9H3,(H,41,50)(H,42,47)(H,43,48)(H,44,49)(H,51,52)(H,53,54)/t23u,24-,25-,26-,28-,29+,30-,31-,33-,34+/m0/s1/f/h41-44,51,53H

InChIKey: InChIKey=MESJISIEDVKBAM-AWXZFASEDR
SMILES: CCC1C(=O)NC(C(C(=O)NC(C(=O)NC(C(C(=O)NC(CCC(=O)N1C)C(=O)O)C)CCC(C)CC(C)C(CC2=CC=CC=C2)OC)C(C)C)C)C(=O)O

Names:
    MOQ
    MOTUPORIN
    (2S,5R,6S,9S,12S,13S,16R)-2-ethyl-12-[(5S,6S)-6-methoxy-3,5-dimethyl-7-phenyl-heptyl]-1,6,13-trimethyl-3,7,10,14,19-pentaoxo-9-propan-2-yl-1,4,8,11,15-pentazacyclononadecane-5,16-dicarboxylic acid
    (2S,5R,6S,9S,12S,13S,16R)-2-ETHYL-9-ISOPROPYL-12-((5S,6S)-6-METHOXY-3,5-DIMETHYL-7-PHENYLHEPTYL)-1,6,13-TRIMETHYL-3,7,10,14,19-PENTAOXO-1,4,8,11,15-PENTAAZACYCLONONADECANE-5,16-DICARBOXYLIC ACID

Registries:
    PubChem CID 5494429
    PubChem ID 8149093