6'-Hydroxyenterolactone

Properties Image MNX_ID MNXM118332 reference chebi:175038 formula C18H18O5 global charge 0 mol weight 314.337 InChIKey OUWRXHXCIKQNEC-XJKSGUPXSA-N InChI InChI=1S/C18H18O5/c19-14-3-1-2-11(6-14)7-16-13(10-23-18(16)22)8-12-9-15(20)4-5-17(12)21/h1-6,9,13,16,19-21H,7-8,10H2/t13-,16+/m0/s1 SMILES O=C1OC[C@H](CC2=C(O)C=CC(O)=C2)[C@H]1CC1=CC(O)=CC=C1 MNX internals InChI (mnx) InChI=1/C18H18O5/c19-14-3-1-2-11(6-14)7-16-13(10-23-18(16)22)8-12-9-15(20)4-5-17(12)21/h1-6,9,13,16,19-21H,7-8,10H2/t13-,16+/m0/s1 SMILES (mnx) [CH:1]1=[CH:2][C:11]([CH2:7][C@@H:16]2[C@@H:13]([CH2:8][C:12]3=[C:17]([OH:21])[CH:5]=[CH:4][C:15]([OH:20])=[CH:9]3)[CH2:10][O:23][C:18]2=[O:22])=[CH:6][C:14]([OH:19])=[CH:3]1

Parent-child relations graph

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