Persicaxanthin

Properties Image MNX_ID MNXM129184 reference hmdb:HMDB0034952 formula C25H36O3 global charge 0 mol weight 384.56 InChIKey JQVNCYNADFKYNN-RXCALXPUSA-N InChI InChI=1S/C25H36O3/c1-19(10-7-8-11-21(3)18-26)12-9-13-20(2)14-15-25-23(4,5)16-22(27)17-24(25,6)28-25/h7-15,22,26-27H,16-18H2,1-6H3/b8-7+,12-9+,15-14+,19-10+,20-13-,21-11- SMILES CC(=C/C=C/C(C)=C/C=C/C=C(/C)CO)/C=C/C12OC1(C)CC(O)CC2(C)C MNX internals InChI (mnx) InChI=1/C25H36O3/c1-19(10-7-8-11-21(3)18-26)12-9-13-20(2)14-15-25-23(4,5)16-22(27)17-24(25,6)28-25/h7-15,22,26-27H,16-18H2,1-6H3/b8-7+,12-9+,15-14+,19-10+,20-13-,21-11-/t22?,24?,25? SMILES (mnx) [CH3:1][C:19](=[CH:10]\[CH:7]=[CH:8]\[CH:11]=[C:21](\[CH3:3])[CH2:18][OH:26])/[CH:12]=[CH:9]/[CH:13]=[C:20]([CH3:2])\[CH:14]=[CH:15]\[C:25]12[C:23]([CH3:4])([CH3:5])[CH2:16][CH:22]([OH:27])[CH2:17][C:24]1([CH3:6])[O:28]2

Parent-child relations graph

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