methyl gibberellin A20

Properties Image MNX_ID MNXM167761 reference metacycM:CPD-12333 formula C20H26O5 global charge 0 mol weight 346.423 InChIKey SXJSUTBDMIRVGQ-QPLUWCFDSA-N InChI InChI=1S/C20H26O5/c1-11-9-18-10-19(11,23)8-5-12(18)20-7-4-6-17(2,16(22)25-20)14(20)13(18)15(21)24-3/h12-14,23H,1,4-10H2,2-3H3/t12-,13-,14-,17+,18+,19+,20-/m1/s1 SMILES C=C1C[C@]23C[C@@]1(O)CC[C@H]2[C@@]12CCC[C@](C)(C(=O)O1)[C@H]2[C@@H]3C(=O)OC MNX internals InChI (mnx) InChI=1/C20H26O5/c1-11-9-18-10-19(11,23)8-5-12(18)20-7-4-6-17(2,16(22)25-20)14(20)13(18)15(21)24-3/h12-14,23H,1,4-10H2,2-3H3/t12-,13-,14-,17+,18+,19+,20-/m1/s1 SMILES (mnx) [CH2:1]=[C:11]1[CH2:9][C@:18]23[CH2:10][C@@:19]1([OH:23])[CH2:8][CH2:5][C@H:12]2[C@:20]12[CH2:7][CH2:4][CH2:6][C@@:17]([CH3:2])([C@H:14]1[C@@H:13]3[C:15](=[O:21])[O:24][CH3:3])[C:16](=[O:22])[O:25]2

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0