Dukunolide B

Properties Image MNX_ID MNXM125128 reference chebi:179871 formula C26H26O10 global charge 0 mol weight 498.484 InChIKey CDCHBVSDWNDPOE-UHFFFAOYSA-N InChI InChI=1S/C26H26O10/c1-20(2)19(29)24(30)10-23-12(34-23)5-7-21(3)14(23)13(17(27)33-15(21)11-6-8-32-9-11)25(24,31)22(4)26(20)16(35-26)18(28)36-22/h6,8-9,12,15-16,30-31H,5,7,10H2,1-4H3 SMILES CC12CCC3OC34CC3(O)C(=O)C(C)(C)C56OC5C(=O)OC6(C)C3(O)C(=C14)C(=O)OC2C1=COC=C1 MNX internals InChI (mnx) InChI=1/C26H26O10/c1-20(2)19(29)24(30)10-23-12(34-23)5-7-21(3)14(23)13(17(27)33-15(21)11-6-8-32-9-11)25(24,31)22(4)26(20)16(35-26)18(28)36-22/h6,8-9,12,15-16,30-31H,5,7,10H2,1-4H3/t12?,15?,16?,21?,22?,23?,24?,25?,26? SMILES (mnx) [CH3:1][C:20]1([CH3:2])[C:19](=[O:29])[C:24]2([OH:30])[CH2:10][C:23]34[CH:12]([CH2:5][CH2:7][C:21]5([CH3:3])[C:14]3=[C:13]([C:17](=[O:27])[O:33][CH:15]5[C:11]3=[CH:9][O:32][CH:8]=[CH:6]3)[C:25]2([OH:31])[C:22]2([CH3:4])[C:26]13[CH:16]([C:18](=[O:28])[O:36]2)[O:35]3)[O:34]4

Parent-child relations graph

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