7-O-methylluteone epoxide

Properties Image MNX_ID MNXM147880 reference metacycM:CPD-15819 formula C21H20O7 global charge 0 mol weight 384.384 InChIKey UXBCQSBJCZFDLT-UHFFFAOYSA-N InChI InChI=1S/C21H20O7/c1-21(2)17(28-21)7-12-15(26-3)8-16-18(19(12)24)20(25)13(9-27-16)11-5-4-10(22)6-14(11)23/h4-6,8-9,17,22-24H,7H2,1-3H3 SMILES COC1=C(CC2OC2(C)C)C(O)=C2C(=O)C(C3=CC=C(O)C=C3O)=COC2=C1 MNX internals InChI (mnx) InChI=1/C21H20O7/c1-21(2)17(28-21)7-12-15(26-3)8-16-18(19(12)24)20(25)13(9-27-16)11-5-4-10(22)6-14(11)23/h4-6,8-9,17,22-24H,7H2,1-3H3/t17? SMILES (mnx) [CH3:1][C:21]1([CH3:2])[CH:17]([CH2:7][C:12]2=[C:19]([OH:24])[C:18]3=[C:16]([CH:8]=[C:15]2[O:26][CH3:3])[O:27][CH:9]=[C:13]([C:11]2=[C:14]([OH:23])[CH:6]=[C:10]([OH:22])[CH:4]=[CH:5]2)[C:20]3=[O:25])[O:28]1

Parent-child relations graph

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