input word = C00038498

Metabolite InformationStructural formula
Name Ardisianoside D
(-)-Ardisianoside D
Formula C46H76O16
Mw 884.51333638
CAS RN 932018-30-9
C_ID C00038498 ,
InChIKey DYAQVNOJMUMVBF-XYYXLBPMNA-N
InChICode InChI=1S/C46H76O16/c1-40(2)14-15-45-21-58-46(27(45)16-40)13-9-26-42(5)11-10-29(41(3,4)25(42)8-12-43(26,6)44(46,7)17-28(45)49)61-37-35(55)32(52)24(20-57-37)60-39-36(33(53)31(51)23(18-47)59-39)62-38-34(54)30(50)22(48)19-56-38/h22-39,47-55H,8-21H2,1-7H3/t22-,23+,24-,25-,26+,27+,28+,29-,30+,31-,32-,33-,34+,35+,36+,37-,38-,39-,42+,43+,44-,45+,46-/m0/s1
SMILES C1[C@@H]2[C@]3(CCC1(C)C)[C@@H](C[C@@]1([C@@]2(CC[C@H]2[C@]1(CC[C@@H]1[C@]2(CC[C@@H](C1(C)C)O[C@@H]1OC[C@@H]([C@@H]([C@H]1O)O)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O[C@@H]1OC[C@@H]([C@H]([C@H]1O)O)O)C)C)OC3)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMyrsinaceaeArdisia japonica Ref.
zoom in