5-epi-valiolone

Properties Image MNX_ID MNXM10304 reference chebi:84361 formula C7H12O6 global charge 0 mol weight 192.167 InChIKey JCZFNXYQGNLHDQ-BNHYGAARSA-N InChI InChI=1S/C7H12O6/c8-2-7(13)1-3(9)4(10)5(11)6(7)12/h4-6,8,10-13H,1-2H2/t4-,5+,6-,7+/m0/s1 SMILES O=C1C[C@@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O MNX internals InChI (mnx) InChI=1/C7H12O6/c8-2-7(13)1-3(9)4(10)5(11)6(7)12/h4-6,8,10-13H,1-2H2/t4-,5+,6-,7+/m0/s1 SMILES (mnx) [CH2:1]1[C:3](=[O:9])[C@H:4]([OH:10])[C@@H:5]([OH:11])[C@H:6]([OH:12])[C@@:7]1([CH2:2][OH:8])[OH:13]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 0