4-Hydroxyenterodiol

Properties Image MNX_ID MNXM117934 reference chebi:175080 formula C18H22O5 global charge 0 mol weight 318.369 InChIKey SSJFHTSLUHPBHD-UHFFFAOYSA-N InChI InChI=1S/C18H22O5/c19-10-14(6-12-2-1-3-16(21)8-12)15(11-20)7-13-4-5-17(22)18(23)9-13/h1-5,8-9,14-15,19-23H,6-7,10-11H2 SMILES OCC(CC1=CC(O)=CC=C1)C(CO)CC1=CC(O)=C(O)C=C1 MNX internals InChI (mnx) InChI=1/C18H22O5/c19-10-14(6-12-2-1-3-16(21)8-12)15(11-20)7-13-4-5-17(22)18(23)9-13/h1-5,8-9,14-15,19-23H,6-7,10-11H2/t14?,15? SMILES (mnx) [CH:1]1=[CH:2][C:12]([CH2:6][CH:14]([CH2:10][OH:19])[CH:15]([CH2:7][C:13]2=[CH:9][C:18]([OH:23])=[C:17]([OH:22])[CH:5]=[CH:4]2)[CH2:11][OH:20])=[CH:8][C:16]([OH:21])=[CH:3]1

Parent-child relations graph

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