N-octadecanoyl-1-O-beta-D-glucosyl-15-methylhexadecasphing-4-enine

Properties Image MNX_ID MNXM107115 reference chebi:71077 formula C41H79NO8 global charge 0 mol weight 714.082 InChIKey WFBBEBGOSHXHCY-LNSDHLJYSA-N InChI InChI=1S/C41H79NO8/c1-4-5-6-7-8-9-10-11-12-13-14-18-21-24-27-30-37(45)42-34(32-49-41-40(48)39(47)38(46)36(31-43)50-41)35(44)29-26-23-20-17-15-16-19-22-25-28-33(2)3/h26,29,33-36,38-41,43-44,46-48H,4-25,27-28,30-32H2,1-3H3,(H,42,45)/b29-26+/t34-,35+,36+,38+,39-,40+,41+/m0/s1 SMILES CCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)/C=C/CCCCCCCCCC(C)C MNX internals InChI (mnx) InChI=1/C41H79NO8/c1-4-5-6-7-8-9-10-11-12-13-14-18-21-24-27-30-37(45)42-34(32-49-41-40(48)39(47)38(46)36(31-43)50-41)35(44)29-26-23-20-17-15-16-19-22-25-28-33(2)3/h26,29,33-36,38-41,43-44,46-48H,4-25,27-28,30-32H2,1-3H3,(H,42,45)/b29-26+/t34-,35+,36+,38+,39-,40+,41+/m0/s1 SMILES (mnx) [CH3:1][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:18][CH2:21][CH2:24][CH2:27][CH2:30][C:37](=[N:42][C@@H:34]([CH2:32][O:49][C@H:41]1[C@H:40]([OH:48])[C@@H:39]([OH:47])[C@H:38]([OH:46])[C@@H:36]([CH2:31][OH:43])[O:50]1)[C@@H:35](/[CH:29]=[CH:26]/[CH2:23][CH2:20][CH2:17][CH2:15][CH2:16][CH2:19][CH2:22][CH2:25][CH2:28][CH:33]([CH3:2])[CH3:3])[OH:44])[OH:45]

Parent-child relations graph

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