L-2-Aminoadipate adenylate

Properties Image MNX_ID MNXM735133 reference chebi:6163 formula C16H23N6O10P global charge 0 mol weight 490.366 InChIKey POJWEBKSMOTPNS-SBZSCLMQSA-N InChI InChI=1S/C16H23N6O10P/c17-7(16(26)27)2-1-3-9(23)32-33(28,29)30-4-8-11(24)12(25)15(31-8)22-6-21-10-13(18)19-5-20-14(10)22/h5-8,11-12,15,24-25H,1-4,17H2,(H,26,27)(H,28,29)(H2,18,19,20)/t7-,8+,11+,12+,15+/m0/s1 SMILES NC1=NC=NC2=C1N=CN2[C@@H]1O[C@H](COP(=O)(O)OC(=O)CCC[C@H](N)C(=O)O)[C@@H](O)[C@H]1O MNX internals InChI (mnx) InChI=1/C16H23N6O10P/c17-7(16(26)27)2-1-3-9(23)32-33(28,29)30-4-8-11(24)12(25)15(31-8)22-6-21-10-13(18)19-5-20-14(10)22/h5-8,11-12,15,24-25H,1-4,17H2,(H,26,27)(H,28,29)(H2,18,19,20)/t7-,8+,11+,12+,15+/m0/s1 SMILES (mnx) [CH2:1]([CH2:2][C@@H:7]([C:16](=[O:26])[OH:27])[NH2:17])[CH2:3][C:9](=[O:23])[O:32][P:33]([OH:28])(=[O:29])[O:30][CH2:4][C@@H:8]1[C@@H:11]([OH:24])[C@@H:12]([OH:25])[C@H:15]([N:22]2[CH:6]=[N:21][C:10]3=[C:13]([NH2:18])[N:19]=[CH:5][N:20]=[C:14]32)[O:31]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 0