input word = C00063884

Metabolite InformationStructural formula
Name Priverosaponin B
Formula C54H88O24
Mw 1120.56655374
CAS RN 144379-38-4
C_ID C00063884
InChIKey RQXSGVGKWHTQKT-UHFFFAOYSA-N
InChICode InChI=1S/C54H88O24/c1-21-30(59)33(62)36(65)44(71-21)77-41-35(64)32(61)23(19-56)73-46(41)75-39-38(67)40(43(68)69)76-47(42(39)78-45-37(66)34(63)31(60)22(18-55)72-45)74-29-11-12-50(6)24(49(29,4)5)9-13-51(7)25(50)10-14-54-26-15-48(2,3)16-27(57)53(26,20-70-54)28(58)17-52(51,54)8/h21-42,44-47,55-67H,9-20H2,1-8H3,(H,68,69)
SMILES CC1OC(OC2C(OC3C(O)C(C(=O)O)OC(OC4CCC5(C)C(CCC6(C)C5CCC57OCC8(C(O)CC(C)(C)CC85)C(O)CC67C)C4(C)C)C3OC3OC(CO)C(O)C(O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePrimulaceaePrimula veris Ref.
zoom in