(8R)-3-oxo-8-hydroxypolypoda13E,17E,21-triene

Properties Image MNX_ID MNXM1131346 reference lipidmapsM:LMPR0106240008 formula C30H50O2 global charge 0 mol weight 442.728 InChIKey CISVDYPCZUPOCT-MDPAFUFQSA-N InChI InChI=1S/C30H50O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-26-29(7)20-19-27(31)28(5,6)25(29)18-21-30(26,8)32/h12,14,16,25-26,32H,9-11,13,15,17-21H2,1-8H3/b23-14+,24-16+/t25-,26?,29-,30+/m0/s1 SMILES CC(C)=CCC/C(C)=C/CC/C(C)=C/CCC1[C@](C)(O)CC[C@H]2C(C)(C)C(=O)CC[C@]12C MNX internals InChI (mnx) InChI=1/C30H50O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-26-29(7)20-19-27(31)28(5,6)25(29)18-21-30(26,8)32/h12,14,16,25-26,32H,9-11,13,15,17-21H2,1-8H3/b23-14+,24-16+/t25-,26?,29-,30+/m0/s1 SMILES (mnx) [CH3:1][C:22]([CH3:2])=[CH:12][CH2:9][CH2:13]/[C:23]([CH3:3])=[CH:14]/[CH2:10][CH2:15]/[C:24]([CH3:4])=[CH:16]/[CH2:11][CH2:17][CH:26]1[C@@:29]2([CH3:7])[CH2:20][CH2:19][C:27](=[O:31])[C:28]([CH3:5])([CH3:6])[C@@H:25]2[CH2:18][CH2:21][C@@:30]1([CH3:8])[OH:32]

Parent-child relations graph

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