chloromonilicin

Properties Image MNX_ID MNXM103777 reference chebi:70291 formula C16H11ClO7 global charge 0 mol weight 350.71 InChIKey XEADRORPHLTLNQ-HNNXBMFYSA-N InChI InChI=1S/C16H11ClO7/c1-6-3-8(18)11-9(4-6)23-14-7(17)5-10(19)24-15(16(21)22-2)12(14)13(11)20/h3-5,15,18H,1-2H3/t15-/m0/s1 SMILES COC(=O)[C@H]1OC(=O)C=C(Cl)C2=C1C(=O)C1=C(O)C=C(C)C=C1O2 MNX internals InChI (mnx) InChI=1/C16H11ClO7/c1-6-3-8(18)11-9(4-6)23-14-7(17)5-10(19)24-15(16(21)22-2)12(14)13(11)20/h3-5,15,18H,1-2H3/t15-/m0/s1 SMILES (mnx) [CH3:1][C:6]1=[CH:3][C:8]([OH:18])=[C:11]2[C:9](=[CH:4]1)[O:23][C:14]1=[C:12]([C:13]2=[O:20])[C@@H:15]([C:16](=[O:21])[O:22][CH3:2])[O:24][C:10](=[O:19])[CH:5]=[C:7]1[Cl:17]

Parent-child relations graph

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