input word = C00060321

Metabolite InformationStructural formula
Name 20S-Sanchirhinoside A5
Formula C47H80O18
Mw 932.53446575
CAS RN 1702363-36-7
C_ID C00060321
InChIKey ZJIIWZQVCDAKFO-VWFCHRHHSA-N
InChICode InChI=1S/C47H80O18/c1-21(2)10-9-13-47(8,65-41-37(59)34(56)31(53)25(18-48)62-41)22-11-15-45(6)30(22)23(51)16-28-44(5)14-12-29(52)43(3,4)39(44)24(17-46(28,45)7)60-42-38(35(57)32(54)26(19-49)63-42)64-40-36(58)33(55)27(20-50)61-40/h10,22-42,48-59H,9,11-20H2,1-8H3/t22-,23+,24-,25+,26+,27-,28+,29-,30-,31+,32+,33-,34-,35-,36+,37+,38+,39-,40-,41-,42+,44+,45+,46+,47-/m0/s1
SMILES CC(C)=CCCC(C)(OC1OC(CO)C(O)C(O)C1O)C1CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3C(OC3OC(CO)C(O)C(O)C3OC3OC(CO)C(O)C3O)CC12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaePanax ginseng Ref.
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