3-O-(Rhaa1-2Glcb)-(25R)-spirost-5en-3beta-ol

Properties Image Occurences in reactions MNX_ID MNXM26296 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C39H62O12 charge 0 mass 722.42413 reference lipidmapsM:LMST01080089 InChIKey HDXIQHTUNGFJIC-YBRCOBKCSA-N InChI InChI=1S/C39H62O12/c1-18-8-13-39(46-17-18)19(2)28-26(51-39)15-25-23-7-6-21-14-22(9-11-37(21,4)24(23)10-12-38(25,28)5)48-36-34(32(44)30(42)27(16-40)49-36)50-35-33(45)31(43)29(41)20(3)47-35/h6,18-20,22-36,40-45H,7-17H2,1-5H3/t18-,19?,20?,22+,23-,24+,25+,26+,27?,28+,29+,30-,31?,32+,33+,34?,35+,36-,37+,38+,39-/m1/s1 SMILES CC1O[C@@H](OC2[C@@H](O)[C@H](O)C(CO)O[C@H]2O[C@H]2CC[C@@]3(C)C(=CC[C@H]4[C@@H]5C[C@@H]6O[C@]7(CC[C@@H](C)CO7)C(C)[C@@H]6[C@@]5(C)CC[C@@H]43)C2)[C@@H](O)C(O)[C@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph