Hordatine B glucoside

Properties Image MNX_ID MNXM126548 reference chebi:192929 formula C35H50N8O10 global charge 0 mol weight 742.831 InChIKey SKTFAQNZNWTXFP-WDZFZDKYSA-N InChI InChI=1S/C35H50N8O10/c1-50-23-17-19(6-11-25(45)40-12-2-4-14-42-34(36)37)16-22-26(32(49)41-13-3-5-15-43-35(38)39)30(53-31(22)23)20-7-9-21(10-8-20)51-33-29(48)28(47)27(46)24(18-44)52-33/h6-11,16-17,24,26-30,33,44,46-48H,2-5,12-15,18H2,1H3,(H,40,45)(H,41,49)(H4,36,37,42)(H4,38,39,43)/b11-6- SMILES COC1=CC(/C=C\C(=O)NCCCCN=C(N)N)=CC2=C1OC(C1=CC=C(OC3OC(CO)C(O)C(O)C3O)C=C1)C2C(=O)NCCCCN=C(N)N MNX internals InChI (mnx) InChI=1/C35H50N8O10/c1-50-23-17-19(6-11-25(45)40-12-2-4-14-42-34(36)37)16-22-26(32(49)41-13-3-5-15-43-35(38)39)30(53-31(22)23)20-7-9-21(10-8-20)51-33-29(48)28(47)27(46)24(18-44)52-33/h6-11,16-17,24,26-30,33,44,46-48H,2-5,12-15,18H2,1H3,(H,40,45)(H,41,49)(H4,36,37,42)(H4,38,39,43)/b11-6-/t24?,26?,27?,28?,29?,30?,33? SMILES (mnx) [CH3:1][O:50][C:23]1=[CH:17][C:19](/[CH:6]=[CH:11]\[C:25](=[N:40]\[CH2:12][CH2:2][CH2:4][CH2:14][NH:42][C:34](=[NH:36])[NH2:37])[OH:45])=[CH:16][C:22]2=[C:31]1[O:53][CH:30]([C:20]1=[CH:8][CH:10]=[C:21]([O:51][CH:33]3[CH:29]([OH:48])[CH:28]([OH:47])[CH:27]([OH:46])[CH:24]([CH2:18][OH:44])[O:52]3)[CH:9]=[CH:7]1)[CH:26]2[C:32](=[N:41][CH2:13][CH2:3][CH2:5][CH2:15][NH:43][C:35](=[NH:38])[NH2:39])[OH:49]

Parent-child relations graph

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