Schizotenuin F

Properties Image MNX_ID MNXM130539 reference chebi:169046 formula C28H24O12 global charge 0 mol weight 552.488 InChIKey JRSJLGASDWZQGF-ILWOKKNDSA-N InChI InChI=1S/C28H24O12/c1-38-28(37)25(14-17-3-7-19(30)21(32)12-17)39-23-8-4-15(10-22(23)33)5-9-26(34)40-24(27(35)36)13-16-2-6-18(29)20(31)11-16/h2-12,14,24,29-33H,13H2,1H3,(H,35,36)/b9-5+,25-14- SMILES COC(=O)/C(=C/C1=CC(O)=C(O)C=C1)OC1=C(O)C=C(/C=C/C(=O)OC(CC2=CC(O)=C(O)C=C2)C(=O)O)C=C1 MNX internals InChI (mnx) InChI=1/C28H24O12/c1-38-28(37)25(14-17-3-7-19(30)21(32)12-17)39-23-8-4-15(10-22(23)33)5-9-26(34)40-24(27(35)36)13-16-2-6-18(29)20(31)11-16/h2-12,14,24,29-33H,13H2,1H3,(H,35,36)/b9-5+,25-14-/t24? SMILES (mnx) [CH3:1][O:38][C:28](/[C:25](=[CH:14]/[C:17]1=[CH:12][C:21]([OH:32])=[C:19]([OH:30])[CH:7]=[CH:3]1)[O:39][C:23]1=[C:22]([OH:33])[CH:10]=[C:15](/[CH:5]=[CH:9]/[C:26](=[O:34])[O:40][CH:24]([CH2:13][C:16]2=[CH:11][C:20]([OH:31])=[C:18]([OH:29])[CH:6]=[CH:2]2)[C:27](=[O:35])[OH:36])[CH:4]=[CH:8]1)=[O:37]

Parent-child relations graph

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