3-Hydroxy-1-phenyl-1-heneicosanone

Properties Image MNX_ID MNXM117439 reference hmdb:HMDB0035681 formula C27H46O2 global charge 0 mol weight 402.663 InChIKey UTLRNQJMWYPIEJ-UHFFFAOYSA-N InChI InChI=1S/C27H46O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-26(28)24-27(29)25-21-18-17-19-22-25/h17-19,21-22,26,28H,2-16,20,23-24H2,1H3 SMILES CCCCCCCCCCCCCCCCCCC(O)CC(=O)C1=CC=CC=C1 MNX internals InChI (mnx) InChI=1/C27H46O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-26(28)24-27(29)25-21-18-17-19-22-25/h17-19,21-22,26,28H,2-16,20,23-24H2,1H3/t26? SMILES (mnx) [CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:20][CH2:23][CH:26]([CH2:24][C:27]([C:25]1=[CH:21][CH:18]=[CH:17][CH:19]=[CH:22]1)=[O:29])[OH:28]

Parent-child relations graph

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