soyasapogenol B-3-O-beta-D-glucoside

Properties Image Occurences in reactions MNX_ID MNXM82510 #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0 formula C36H60O8 charge 0 mass 620.42882 reference metacycM:CPD-9489 InChIKey SOMDRJIVEKIXDG-DYJSFFMXSA-N InChI InChI=1S/C36H60O8/c1-31(2)16-21-20-8-9-24-33(4)12-11-26(44-30-29(42)28(41)27(40)22(18-37)43-30)34(5,19-38)23(33)10-13-36(24,7)35(20,6)15-14-32(21,3)25(39)17-31/h8,21-30,37-42H,9-19H2,1-7H3/t21-,22+,23+,24+,25+,26-,27+,28-,29+,30-,32+,33-,34+,35+,36+/m0/s1 SMILES CC1(C)C[C@H]2C3=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@](C)(CO)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@@]2(C)[C@H](O)C1

Parent-child relations graph

Deprecated MNXref IDs graph