3-O-(alpha-L-arabinopyranosyl-(1->6)-beta-D-glucopyranosyl) butyl 3R-hydroxybutanoate

Properties Image MNX_ID MNXM100462 reference lipidmapsM:LMFA13010045 formula C19H34O12 global charge 0 mol weight 454.469 InChIKey MLIAQAVEASULJH-UYQTUCCPSA-N InChI InChI=1S/C19H34O12/c1-3-4-5-27-12(21)6-9(2)30-19-17(26)15(24)14(23)11(31-19)8-29-18-16(25)13(22)10(20)7-28-18/h9-11,13-20,22-26H,3-8H2,1-2H3/t9-,10+,11-,13+,14-,15+,16-,17-,18+,19-/m1/s1 SMILES CCCCOC(=O)C[C@@H](C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O MNX internals InChI (mnx) InChI=1/C19H34O12/c1-3-4-5-27-12(21)6-9(2)30-19-17(26)15(24)14(23)11(31-19)8-29-18-16(25)13(22)10(20)7-28-18/h9-11,13-20,22-26H,3-8H2,1-2H3/t9-,10+,11-,13+,14-,15+,16-,17-,18+,19-/m1/s1 SMILES (mnx) [CH3:1][CH2:3][CH2:4][CH2:5][O:27][C:12]([CH2:6][C@@H:9]([CH3:2])[O:30][C@H:19]1[C@H:17]([OH:26])[C@@H:15]([OH:24])[C@H:14]([OH:23])[C@@H:11]([CH2:8][O:29][C@H:18]2[C@H:16]([OH:25])[C@@H:13]([OH:22])[C@@H:10]([OH:20])[CH2:7][O:28]2)[O:31]1)=[O:21]

Parent-child relations graph

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