input word = C00010655

Metabolite InformationStructural formula
Name Penstebioside
Formula C27H42O15
Mw 606.25237067
CAS RN 109291-58-9
C_ID C00010655 ,
InChIKey NPCCFNTZZXOWME-HWDWPKRUNA-N
InChICode InChI=1S/C27H42O15/c1-11(2)5-17(31)41-25-18-12(6-28)3-4-14(18)13(9-37-25)10-38-26-23(36)21(34)24(16(8-30)40-26)42-27-22(35)20(33)19(32)15(7-29)39-27/h3,9,11,14-16,18-30,32-36H,4-8,10H2,1-2H3/t14-,15+,16-,18-,19+,20-,21+,22-,23-,24+,25-,26-,27-/m0/s1
SMILES CC(C)CC(=O)OC1OC=C(COC2OC(CO)[C@@H](O[C@@H]3OC(CO)[C@@H](O)C(O)[C@@H]3O)C(O)[C@@H]2O)C2CC=C(CO)C12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePlantaginaceaePenstemon richardsonii Ref.
zoom in