(S,S)-trans-1-isopropyl-2,3,3,5-tetramethyl-6-succinylindane

Properties Image MNX_ID MNXM31905 reference chebi:46099 formula C20H28O3 global charge 0 mol weight 316.441 InChIKey YUTXECPABXNXPU-DJJJIMSYSA-N InChI InChI=1S/C20H28O3/c1-11(2)19-13(4)20(5,6)16-9-12(3)14(10-15(16)19)17(21)7-8-18(22)23/h9-11,13,19H,7-8H2,1-6H3,(H,22,23)/t13-,19-/m0/s1 SMILES CC1=C(C(=O)CCC(=O)O)C=C2C(=C1)C(C)(C)[C@@H](C)[C@@H]2C(C)C MNX internals InChI (mnx) InChI=1/C20H28O3/c1-11(2)19-13(4)20(5,6)16-9-12(3)14(10-15(16)19)17(21)7-8-18(22)23/h9-11,13,19H,7-8H2,1-6H3,(H,22,23)/t13-,19-/m0/s1 SMILES (mnx) [CH3:1][CH:11]([CH3:2])[C@H:19]1[C@H:13]([CH3:4])[C:20]([CH3:5])([CH3:6])[C:16]2=[C:15]1[CH:10]=[C:14]([C:17]([CH2:7][CH2:8][C:18](=[O:22])[OH:23])=[O:21])[C:12]([CH3:3])=[CH:9]2

Parent-child relations graph

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