Glaucarubol 15-O-beta-D-glucopyranoside

Properties Image MNX_ID MNXM126113 reference chebi:187582 formula C26H38O13 global charge 0 mol weight 558.577 InChIKey LEELVKKBWHNOAU-UHFFFAOYSA-N InChI InChI=1S/C26H38O13/c1-8-4-11(28)20(33)24(3)10(8)5-13-25-7-36-26(35,23(24)25)19(32)9(2)14(25)18(21(34)38-13)39-22-17(31)16(30)15(29)12(6-27)37-22/h4,9-20,22-23,27-33,35H,5-7H2,1-3H3 SMILES CC1=CC(O)C(O)C2(C)C1CC1OC(=O)C(OC3OC(CO)C(O)C(O)C3O)C3C(C)C(O)C4(O)OCC13C42 MNX internals InChI (mnx) InChI=1/C26H38O13/c1-8-4-11(28)20(33)24(3)10(8)5-13-25-7-36-26(35,23(24)25)19(32)9(2)14(25)18(21(34)38-13)39-22-17(31)16(30)15(29)12(6-27)37-22/h4,9-20,22-23,27-33,35H,5-7H2,1-3H3/t9?,10?,11?,12?,13?,14?,15?,16?,17?,18?,19?,20?,22?,23?,24?,25?,26? SMILES (mnx) [CH3:1][C:8]1=[CH:4][CH:11]([OH:28])[CH:20]([OH:33])[C:24]2([CH3:3])[CH:10]1[CH2:5][CH:13]1[C:25]34[CH2:7][O:36][C:26]([OH:35])([CH:19]([OH:32])[CH:9]([CH3:2])[CH:14]3[CH:18]([O:39][CH:22]3[CH:17]([OH:31])[CH:16]([OH:30])[CH:15]([OH:29])[CH:12]([CH2:6][OH:27])[O:37]3)[C:21](=[O:34])[O:38]1)[CH:23]24

Parent-child relations graph

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