cspyrone B1

Properties Image MNX_ID MNXM47854 reference chebi:64497 formula C10H10O6 global charge 0 mol weight 226.184 InChIKey AHSXBCFJMIOPSN-UHFFFAOYSA-N InChI InChI=1S/C10H10O6/c1-5(11)9-7(12)4-6(16-10(9)15)2-3-8(13)14/h4,12H,2-3H2,1H3,(H,13,14) SMILES CC(=O)C1=C(O)C=C(CCC(=O)O)OC1=O MNX internals InChI (mnx) InChI=1/C10H10O6/c1-5(11)9-7(12)4-6(16-10(9)15)2-3-8(13)14/h4,12H,2-3H2,1H3,(H,13,14) SMILES (mnx) [CH3:1][C:5]([C:9]1=[C:7]([OH:12])[CH:4]=[C:6]([CH2:2][CH2:3][C:8](=[O:13])[OH:14])[O:16][C:10]1=[O:15])=[O:11]

Parent-child relations graph

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