4-OH-9-cis-retinal

Properties Image MNX_ID MNXM164317 reference biggM:CE5592 formula C20H28O2 global charge 0 mol weight 300.442 InChIKey CYVVUYORRQQAQE-PTUYJDPBSA-N InChI InChI=1S/C20H28O2/c1-15(7-6-8-16(2)12-14-21)9-10-18-17(3)19(22)11-13-20(18,4)5/h6-10,12,14,19,22H,11,13H2,1-5H3/b8-6+,10-9+,15-7-,16-12? SMILES CC(=CC=O)/C=C/C=C(C)\C=C\C1=C(C)C(O)CCC1(C)C MNX internals InChI (mnx) InChI=1/C20H28O2/c1-15(7-6-8-16(2)12-14-21)9-10-18-17(3)19(22)11-13-20(18,4)5/h6-10,12,14,19,22H,11,13H2,1-5H3/b8-6+,10-9+,15-7-,16-12+/t19? SMILES (mnx) [CH3:1][C:15](=[CH:7]/[CH:6]=[CH:8]/[C:16]([CH3:2])=[CH:12]/[CH:14]=[O:21])/[CH:9]=[CH:10]/[C:18]1=[C:17]([CH3:3])[CH:19]([OH:22])[CH2:11][CH2:13][C:20]1([CH3:4])[CH3:5]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 2