Two linked disacharide tripeptide murein units (uncrosslinked, middle of chain)

Properties Image Occurences in reactions MNX_ID MNXM741021 #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 10 formula C68H104N12O38 charge -4 mass 1696.65964 reference biggM:murein3p3p InChIKey QKZNHGKXDALVQW-UHFFFAOYSA-J InChI InChI=1S/C68H108N12O38/c1-24(56(96)77-34(15-17-43(89)90)60(100)79-36(64(106)107)13-9-11-32(69)62(102)103)71-58(98)26(3)111-51-38(73-28(5)85)23-110-40(20-82)53(51)117-67-46(75-30(7)87)50(95)52(41(21-83)114-67)116-68-47(76-31(8)88)55(54(42(22-84)115-68)118-66-45(74-29(6)86)49(94)48(93)39(19-81)113-66)112-27(4)59(99)72-25(2)57(97)78-35(16-18-44(91)92)61(101)80-37(65(108)109)14-10-12-33(70)63(104)105/h23-27,32-37,39-42,45-55,66-68,81-84,93-95H,9-22,69-70H2,1-8H3,(H,71,98)(H,72,99)(H,73,85)(H,74,86)(H,75,87)(H,76,88)(H,77,96)(H,78,97)(H,79,100)(H,80,101)(H,89,90)(H,91,92)(H,102,103)(H,104,105)(H,106,107)(H,108,109)/p-4 SMILES CC(=O)NC1=COC(CO)C(OC2OC(CO)C(OC3OC(CO)C(OC4OC(CO)C(O)C(O)C4NC(C)=O)C(OC(C)C(=O)NC(C)C(=O)NC(CCC(=O)[O-])C(=O)NC(CCCC([NH3+])C(=O)[O-])C(=O)[O-])C3NC(C)=O)C(O)C2NC(C)=O)C1OC(C)C(=O)NC(C)C(=O)NC(CCC(=O)[O-])C(=O)NC(CCCC([NH3+])C(=O)[O-])C(=O)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph