beta-Peltatin A methyl ether

Properties Image MNX_ID MNXM13301 reference chebi:10437 formula C23H24O8 global charge 0 mol weight 428.437 InChIKey BFKORKXLSJUYSS-RQUSPXKASA-N InChI InChI=1S/C23H24O8/c1-25-15-6-11(7-16(26-2)21(15)28-4)18-13-8-17-22(31-10-30-17)20(27-3)14(13)5-12-9-29-23(24)19(12)18/h6-8,12,18-19H,5,9-10H2,1-4H3/t12-,18+,19-/m0/s1 SMILES COC1=CC([C@@H]2C3=C(C[C@H]4COC(=O)[C@@H]42)C(OC)=C2OCOC2=C3)=CC(OC)=C1OC MNX internals InChI (mnx) InChI=1/C23H24O8/c1-25-15-6-11(7-16(26-2)21(15)28-4)18-13-8-17-22(31-10-30-17)20(27-3)14(13)5-12-9-29-23(24)19(12)18/h6-8,12,18-19H,5,9-10H2,1-4H3/t12-,18+,19-/m0/s1 SMILES (mnx) [CH3:1][O:25][C:15]1=[C:21]([O:28][CH3:4])[C:16]([O:26][CH3:2])=[CH:7][C:11]([C@@H:18]2[C:13]3=[C:14]([CH2:5][C@H:12]4[CH2:9][O:29][C:23](=[O:24])[C@@H:19]42)[C:20]([O:27][CH3:3])=[C:22]2[C:17](=[CH:8]3)[O:30][CH2:10][O:31]2)=[CH:6]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 0