isotrichotriol

Properties Image MNX_ID MNXM164854 reference metacycM:CPD-18384 formula C15H24O4 global charge 0 mol weight 268.353 InChIKey WGOGDSNCSQGSSF-ZLMXSUKOSA-N InChI InChI=1S/C15H24O4/c1-9-4-5-13(2,11(17)6-9)14(3)7-10(16)12(18)15(14)8-19-15/h6,10-12,16-18H,4-5,7-8H2,1-3H3/t10?,11?,12?,13-,14+,15?/m0/s1 SMILES CC1=CC(O)[C@@](C)([C@@]2(C)CC(O)C(O)C23CO3)CC1 MNX internals InChI (mnx) InChI=1/C15H24O4/c1-9-4-5-13(2,11(17)6-9)14(3)7-10(16)12(18)15(14)8-19-15/h6,10-12,16-18H,4-5,7-8H2,1-3H3/t10?,11?,12?,13-,14+,15?/m0/s1 SMILES (mnx) [CH3:1][C:9]1=[CH:6][CH:11]([OH:17])[C@@:13]([CH3:2])([C@@:14]2([CH3:3])[CH2:7][CH:10]([OH:16])[CH:12]([OH:18])[C:15]23[CH2:8][O:19]3)[CH2:5][CH2:4]1

Parent-child relations graph

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