compound 0288477

Properties Image Occurences in reactions MNX_ID MNXM1227387 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C48H70N10O13 charge -2 mass 994.51348 reference envipathM:...92140b9a16f6 InChIKey FCVUAFCOQAOQFK-JLKLMBRUSA-L InChI InChI=1S/C48H72N10O13/c1-25(2)22-34-43(64)58-38(45(67)68)28(5)39(60)54-32(16-13-21-51-47(49)50)42(63)57-36(19-17-26(3)23-27(4)35(71-9)24-31-14-11-10-12-15-31)48(8,70)46(69)56-33(44(65)66)18-20-37(59)52-29(6)40(61)53-30(7)41(62)55-34/h10-12,14-15,17,19,23,25,27-28,30,32-36,38,70H,6,13,16,18,20-22,24H2,1-5,7-9H3,(H,52,59)(H,53,61)(H,54,60)(H,55,62)(H,56,69)(H,57,63)(H,58,64)(H,65,66)(H,67,68)(H4,49,50,51)/p-2/b19-17+,26-23+/t27-,28-,30+,32-,33+,34-,35-,36-,38+,48+/m0/s1 SMILES C=C1NC(=O)CC[C@H](C(=O)[O-])NC(=O)[C@](C)(O)[C@H](/C=C/C(C)=C/[C@H](C)[C@H](Cc2ccccc2)OC)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](C)[C@H](C(=O)[O-])NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC1=O

Parent-child relations graph

Deprecated MNXref IDs graph