N-(ADP-D-ribosyl)diphthamide-[translation elongation factor 2]

Properties Image MNX_ID MNXM737377 reference metacycM:CPD-12345 formula C28H42N10O15P2*2 global charge 0 mol weight   InChIKey   InChI   SMILES [*]N[C@@H](CC1=NC(CC[C@@H](C(N)=O)[N+](C)(C)C)[N+]([C@@H]2O[C@H](COP(=O)([O-])OP(=O)([O-])OC[C@H]3O[C@@H](N4C=NC5=C(N)N=CN=C54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)=C1)C([*])=O MNX internals InChI (mnx) InChI=1/C30H48N10O15P2/c1-14(41)16(33-2)8-15-9-38(20(37-15)7-6-17(27(32)46)40(3,4)5)29-24(44)22(42)18(53-29)10-51-56(47,48)55-57(49,50)52-11-19-23(43)25(45)30(54-19)39-13-36-21-26(31)34-12-35-28(21)39/h9,12-13,16-20,22-25,29-30,33,42-45H,6-8,10-11H2,1-5H3,(H4-2,31,32,34,35,46,47,48,49,50)/t16-,17-,18+,19+,20?,22+,23+,24+,25+,29+,30+/m0/s1/i1+1,2+1 SMILES (mnx) [13CH3:1][C:14]([C@H:16]([CH2:8][C:15]1=[N:37][CH:20]([CH2:7][CH2:6][C@@H:17]([C:27](=[NH:32])[OH:46])[N+:40]([CH3:3])([CH3:4])[CH3:5])[N+:38]([C@H:29]2[C@H:24]([OH:44])[C@H:22]([OH:42])[C@@H:18]([CH2:10][O:51][P:56](=[O:47])([O-:48])[O:55][P:57](=[O:49])([O-:50])[O:52][CH2:11][C@@H:19]3[C@@H:23]([OH:43])[C@@H:25]([OH:45])[C@H:30]([N:39]4[CH:13]=[N:36][C:21]5=[C:26]([NH2:31])[N:34]=[CH:12][N:35]=[C:28]54)[O:54]3)[O:53]2)=[CH:9]1)[NH:33][13CH3:2])=[O:41]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0