pleosporone

Properties Image MNX_ID MNXM108092 reference chebi:66765 formula C15H14O6 global charge 0 mol weight 290.271 InChIKey YUSJPHSHLVVZRA-DYQSUWPFSA-N InChI InChI=1S/C15H14O6/c1-5-2-6-10(8(16)3-5)14(20)11-7(12(6)18)4-9(17)13(19)15(11)21/h2-3,9,13,15-17,19,21H,4H2,1H3/t9-,13-,15+/m0/s1 SMILES CC1=CC(O)=C2C(=O)C3=C(C[C@H](O)[C@H](O)[C@@H]3O)C(=O)C2=C1 MNX internals InChI (mnx) InChI=1/C15H14O6/c1-5-2-6-10(8(16)3-5)14(20)11-7(12(6)18)4-9(17)13(19)15(11)21/h2-3,9,13,15-17,19,21H,4H2,1H3/t9-,13-,15+/m0/s1 SMILES (mnx) [CH3:1][C:5]1=[CH:2][C:6]2=[C:10]([C:8]([OH:16])=[CH:3]1)[C:14](=[O:20])[C:11]1=[C:7]([CH2:4][C@H:9]([OH:17])[C@H:13]([OH:19])[C@@H:15]1[OH:21])[C:12]2=[O:18]

Parent-child relations graph

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