4,2',3',4',6'-Pentahydroxy-5'-neryldihydrochalcone

Properties Image MNX_ID MNXM25494 reference lipidmapsM:LMPK12120560 formula C25H30O6 global charge 0 mol weight 426.509 InChIKey NMIIWAISRYUHLN-APSNUPSMSA-N InChI InChI=1S/C25H30O6/c1-15(2)5-4-6-16(3)7-13-19-22(28)21(24(30)25(31)23(19)29)20(27)14-10-17-8-11-18(26)12-9-17/h5,7-9,11-12,26,28-31H,4,6,10,13-14H2,1-3H3/b16-7- SMILES CC(C)=CCC/C(C)=C\CC1=C(O)C(O)=C(O)C(C(=O)CCC2=CC=C(O)C=C2)=C1O MNX internals InChI (mnx) InChI=1/C25H30O6/c1-15(2)5-4-6-16(3)7-13-19-22(28)21(24(30)25(31)23(19)29)20(27)14-10-17-8-11-18(26)12-9-17/h5,7-9,11-12,26,28-31H,4,6,10,13-14H2,1-3H3/b16-7- SMILES (mnx) [CH3:1][C:15]([CH3:2])=[CH:5][CH2:4][CH2:6]/[C:16]([CH3:3])=[CH:7]\[CH2:13][C:19]1=[C:22]([OH:28])[C:21]([C:20]([CH2:14][CH2:10][C:17]2=[CH:9][CH:12]=[C:18]([OH:26])[CH:11]=[CH:8]2)=[O:27])=[C:24]([OH:30])[C:25]([OH:31])=[C:23]1[OH:29]

Parent-child relations graph

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