Gibberellin A123

Properties Image MNX_ID MNXM126000 reference chebi:175671 formula C20H28O6 global charge 0 mol weight 364.438 InChIKey PIKIDCPJSQIMHW-JOJUGDBLSA-N InChI InChI=1S/C20H28O6/c1-10-8-19-9-20(10,26)12(21)7-11(19)17(2)5-4-6-18(3,16(24)25)14(17)13(19)15(22)23/h11-14,21,26H,1,4-9H2,2-3H3,(H,22,23)(H,24,25)/t11-,12-,13+,14-,17-,18+,19-,20-/m0/s1 SMILES C=C1C[C@]23C[C@@]1(O)[C@@H](O)C[C@H]2[C@]1(C)CCC[C@@](C)(C(=O)O)[C@H]1[C@@H]3C(=O)O MNX internals InChI (mnx) InChI=1/C20H28O6/c1-10-8-19-9-20(10,26)12(21)7-11(19)17(2)5-4-6-18(3,16(24)25)14(17)13(19)15(22)23/h11-14,21,26H,1,4-9H2,2-3H3,(H,22,23)(H,24,25)/t11-,12-,13+,14-,17-,18+,19-,20-/m0/s1 SMILES (mnx) [CH2:1]=[C:10]1[CH2:8][C@:19]23[CH2:9][C@@:20]1([OH:26])[C@@H:12]([OH:21])[CH2:7][C@H:11]2[C@:17]1([CH3:2])[CH2:5][CH2:4][CH2:6][C@@:18]([CH3:3])([C:16](=[O:24])[OH:25])[C@H:14]1[C@@H:13]3[C:15](=[O:22])[OH:23]

Parent-child relations graph

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