Polyporusterone E

Properties Image MNX_ID MNXM129824 reference chebi:175653 formula C28H44O5 global charge 0 mol weight 460.655 InChIKey BBNQTVHCXTWVJZ-QOOAPMMESA-N InChI InChI=1S/C28H44O5/c1-14(2)15(3)24-25(33-24)16(4)17-8-10-28(32)19-11-21(29)20-12-22(30)23(31)13-26(20,5)18(19)7-9-27(17,28)6/h11,14-18,20,22-25,30-32H,7-10,12-13H2,1-6H3/t15-,16+,17-,18+,20+,22-,23+,24+,25+,26-,27-,28-/m1/s1 SMILES CC(C)[C@@H](C)[C@@H]1O[C@H]1[C@@H](C)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C MNX internals InChI (mnx) InChI=1/C28H44O5/c1-14(2)15(3)24-25(33-24)16(4)17-8-10-28(32)19-11-21(29)20-12-22(30)23(31)13-26(20,5)18(19)7-9-27(17,28)6/h11,14-18,20,22-25,30-32H,7-10,12-13H2,1-6H3/t15-,16+,17-,18+,20+,22-,23+,24+,25+,26-,27-,28-/m1/s1 SMILES (mnx) [CH3:1][CH:14]([CH3:2])[C@@H:15]([CH3:3])[C@H:24]1[C@H:25]([C@@H:16]([CH3:4])[C@H:17]2[CH2:8][CH2:10][C@@:28]3([OH:32])[C:19]4=[CH:11][C:21](=[O:29])[C@@H:20]5[CH2:12][C@@H:22]([OH:30])[C@@H:23]([OH:31])[CH2:13][C@:26]5([CH3:5])[C@H:18]4[CH2:7][CH2:9][C@:27]23[CH3:6])[O:33]1

Parent-child relations graph

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