cleomiscosin A

Properties Image MNX_ID MNXM47213 reference chebi:3740 formula C20H18O8 global charge 0 mol weight 386.356 InChIKey OCBGWPJNUZMLCA-NVXWUHKLSA-N InChI InChI=1S/C20H18O8/c1-24-13-7-10(3-5-12(13)22)17-15(9-21)26-20-18-11(4-6-16(23)27-18)8-14(25-2)19(20)28-17/h3-8,15,17,21-22H,9H2,1-2H3/t15-,17-/m1/s1 SMILES COC1=CC([C@H]2OC3=C(OC)C=C4C=CC(=O)OC4=C3O[C@@H]2CO)=CC=C1O MNX internals InChI (mnx) InChI=1/C20H18O8/c1-24-13-7-10(3-5-12(13)22)17-15(9-21)26-20-18-11(4-6-16(23)27-18)8-14(25-2)19(20)28-17/h3-8,15,17,21-22H,9H2,1-2H3/t15-,17-/m1/s1 SMILES (mnx) [CH3:1][O:24][C:13]1=[C:12]([OH:22])[CH:5]=[CH:3][C:10]([C@@H:17]2[C@@H:15]([CH2:9][OH:21])[O:26][C:20]3=[C:18]4[C:11](=[CH:8][C:14]([O:25][CH3:2])=[C:19]3[O:28]2)[CH:4]=[CH:6][C:16](=[O:23])[O:27]4)=[CH:7]1

Parent-child relations graph

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