Name: (S)-4-(3-((S)-6-(bis((1-(2-tert-butoxy-2-oxoethyl)-1H-imidazol-2-yl)methyl)amino)-1-tert-butoxy-1-oxohexan-2-yl)ureido)-5-tert-butoxy-5-oxopentanoic acid
IUPAC: (4S)-4-[[(2S)-6-[bis[[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]imidazol-2-yl]methyl]amino]-1-[(2-methylpropan-2-yl)oxy]-1-oxohexan-2-yl]carbamoylamino]-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid
SMILES:
CC(C)(C)OC(=O)Cn1ccnc1CN(CCCC[C@H](NC(=O)N[C@@H](CCC(=O)O)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)Cc1nccn1CC(=O)OC(C)(C)CCanonical SMILES:
CC(C)(C)OC(=O)CN1C=CN=C1CN(CCCCC(C(=O)OC(C)(C)C)NC(=O)NC(CCC(=O)O)C(=O)OC(C)(C)C)CC2=NC=CN2CC(=O)OC(C)(C)CSummenformel: C40H65N7O11
Molare Masse: 820.00
InChIKey: BPYUHKIJYXVDHA-NSOVKSMOSA-N
InChI:
PubChem CID: 59404337 →InChI=1S/C40H65N7O11/c1-37(2,3)55-32(50)25-46-21-18-41-29(46)23-45(24-30-42-19-22-47(30)26-33(51)56-38(4,5)6)20-14-13-15-27(34(52)57-39(7,8)9)43-36(54)44-28(16-17-31(48)49)35(53)58-40(10,11)12/h18-19,21-22,27-28H,13-17,20,23-26H2,1-12H3,(H,48,49)(H2,43,44,54)/t27-,28-/m0/s1Synonyme
SCHEMBL2834575BPYUHKIJYXVDHA-NSOVKSMOSA-N(S)-4-(3-((S)-6-(bis((1-(2-tert-butoxy-2-oxoethyl)-1H-imidazol-2-yl)methyl)amino)-1-tert-butoxy-1-oxohexan-2-yl)ureido)-5-tert-butoxy-5-oxopentanoic acid
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