input word = C00059849

Metabolite InformationStructural formula
Name Ginsenoside Rh18
Formula C48H80O18
Mw 944.53446575
CAS RN 1402410-67-6
C_ID C00059849
InChIKey AQSGBQKLUCVMDT-XKZITUTMSA-N
InChICode InChI=1S/C48H80O18/c1-20(2)14-22-16-48(9,66-42-38(59)35(56)32(53)26(18-49)63-42)23-10-13-46(7)30(23)24(61-22)15-28-45(6)12-11-29(51)44(4,5)40(45)25(17-47(28,46)8)62-43-39(36(57)33(54)27(19-50)64-43)65-41-37(58)34(55)31(52)21(3)60-41/h14,21-43,49-59H,10-13,15-19H2,1-9H3/t21-,22-,23-,24+,25-,26+,27+,28+,29-,30-,31-,32+,33+,34+,35-,36-,37+,38+,39+,40-,41-,42-,43+,45+,46+,47+,48-/m0/s1
SMILES CC(C)=CC1CC(C)(OC2OC(CO)C(O)C(O)C2O)C2CCC3(C)C2C(CC2C4(C)CCC(O)C(C)(C)C4C(OC4OC(CO)C(O)C(O)C4OC4OC(C)C(O)C(O)C4O)CC23C)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaePanax ginseng Ref.
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