3'-deoxyepisappanol

Properties Image MNX_ID MNXM101748 reference chebi:69198 formula C16H16O5 global charge 0 mol weight 288.299 InChIKey IYAYKNOVHBOSPH-HZPDHXFCSA-N InChI InChI=1S/C16H16O5/c17-11-3-1-10(2-4-11)8-16(20)9-21-14-7-12(18)5-6-13(14)15(16)19/h1-7,15,17-20H,8-9H2/t15-,16-/m1/s1 SMILES OC1=CC=C(C[C@@]2(O)COC3=CC(O)=CC=C3[C@H]2O)C=C1 MNX internals InChI (mnx) InChI=1/C16H16O5/c17-11-3-1-10(2-4-11)8-16(20)9-21-14-7-12(18)5-6-13(14)15(16)19/h1-7,15,17-20H,8-9H2/t15-,16-/m1/s1 SMILES (mnx) [CH:1]1=[CH:3][C:11]([OH:17])=[CH:4][CH:2]=[C:10]1[CH2:8][C@@:16]1([OH:20])[CH2:9][O:21][C:14]2=[C:13]([CH:6]=[CH:5][C:12]([OH:18])=[CH:7]2)[C@H:15]1[OH:19]

Parent-child relations graph

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