**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

beta-solanine

Properties Image Occurences in reactions MNX_ID MNXM728092 #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 0 formula C39H64NO11 charge 1 mass 722.937 reference seedM:cpd25606 InChIKey OCVQAFQRXHOFMV-IEGURRFDSA-O InChI InChI=1S/C39H63NO11/c1-18-5-8-25-19(2)29-26(40(25)15-18)14-24-22-7-6-20-13-21(9-11-38(20,3)23(22)10-12-39(24,29)4)48-37-34(47)35(31(44)28(17-42)50-37)51-36-33(46)32(45)30(43)27(16-41)49-36/h6,18-19,21-37,41-47H,5,7-17H2,1-4H3/p+1/t18-,19+,21-,22+,23-,24-,25+,26-,27+,28+,29-,30+,31-,32-,33+,34+,35-,36-,37+,38-,39-/m0/s1 SMILES [CH3:1][C@H:18]1[CH2:5][CH2:8][C@@H:25]2[C@@H:19]([CH3:2])[C@H:29]3[C@H:26]([CH2:14][C@H:24]4[C@@H:22]5[CH2:7][CH:6]=[C:20]6[CH2:13][C@@H:21]([O:48][C@H:37]7[C@H:34]([OH:47])[C@@H:35]([O:51][C@H:36]8[C@H:33]([OH:46])[C@@H:32]([OH:45])[C@H:30]([OH:43])[C@@H:27]([CH2:16][OH:41])[O:49]8)[C@@H:31]([OH:44])[C@@H:28]([CH2:17][OH:42])[O:50]7)[CH2:9][CH2:11][C@:38]6([CH3:3])[C@H:23]5[CH2:10][CH2:12][C@@:39]43[CH3:4])[N:40]2[CH2:15]1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources

Identifier	Description
metacyc.compound:CPD-9212 metacycM:CPD-9212 seed.compound:cpd25606 seedM:cpd25606	beta-solanine
hmdb:HMDB0033696	beta-Solanine 2-{[3,5-dihydroxy-2-(hydroxymethyl)-6-({10,14,16,20-tetramethyl-22-azahexacyclo[12.10.0.0²,¹¹.0⁵,¹⁰.0¹⁵,²³.0¹⁷,²²]tetracos-4-en-7-yl}oxy)oxan-4-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol b-Solanine beta-solanine
hmdb:HMDB33696 seedM:M_cpd25606	secondary/obsolete/fantasy identifier