input word = C00055119

Metabolite InformationStructural formula
Name Ampeloside Bf1
Formula C51H86O26
Mw 1114.54073292
CAS RN 118524-13-3
C_ID C00055119
InChIKey RPLNTGAJLNTPGI-UHFFFAOYSA-N
InChICode InChI=1S/C51H86O26/c1-18(17-69-45-39(64)36(61)33(58)28(13-52)71-45)5-8-51(68)19(2)32-27(77-51)10-22-20-9-24(56)23-11-26(25(57)12-50(23,4)21(20)6-7-49(22,32)3)70-46-41(66)38(63)43(31(16-55)74-46)75-48-42(67)44(35(60)30(15-54)73-48)76-47-40(65)37(62)34(59)29(14-53)72-47/h18-48,52-68H,5-17H2,1-4H3
SMILES OC1C(OC2C(O)C(CO)OC(OC3C(O)C(O)C(OC4CC(C(O)CC5C6CCC7(C)C5CC8C7C(C)C(CCC(C)COC9C(O)C(O)C(O)C(CO)O9)(O)O8)C6(C)CC4O)OC3CO)C2O)OC(CO)C(O)C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAlliaceaeAllium ampeloprasum Ref.
zoom in



OrganismAllium ampeloprasum
ReferencePirtskhalava, G.V. et al., Khim. Prir. Soedin., 1979, 15, 514

Chem. Nat. Compd. (Engl. Transl.), 446