3-O-(Glcb1-3Glcb1-4(Rhaa1-2)Glcb)-(25R)-spirost-5-en-3beta-ol

Properties Image Occurences in reactions MNX_ID MNXM22888 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C51H82O22 charge 0 mass 1046.52977 reference lipidmapsM:LMST01080056 InChIKey XJOTXMLDNWCDRH-WEORSTGQSA-N InChI InChI=1S/C51H82O22/c1-20-8-13-51(64-19-20)21(2)32-28(73-51)15-27-25-7-6-23-14-24(9-11-49(23,4)26(25)10-12-50(27,32)5)66-48-44(72-45-38(60)36(58)33(55)22(3)65-45)40(62)42(31(18-54)69-48)70-47-41(63)43(35(57)30(17-53)68-47)71-46-39(61)37(59)34(56)29(16-52)67-46/h6,20-22,24-48,52-63H,7-19H2,1-5H3/t20-,21+,22?,24+,25-,26+,27+,28+,29?,30?,31?,32+,33+,34-,35-,36?,37+,38+,39?,40+,41?,42-,43+,44?,45+,46+,47+,48-,49+,50+,51-/m1/s1 SMILES CC1O[C@@H](OC2[C@@H](O)[C@H](O[C@@H]3OC(CO)[C@@H](O)[C@H](O[C@@H]4OC(CO)[C@@H](O)[C@H](O)C4O)C3O)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@@H](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