input word = C00033396

Metabolite InformationStructural formula
Name Suffruticoside A
Formula C27H32O16
Mw 612.16903498
CAS RN 145898-94-8
C_ID C00033396 ,
InChIKey QNVPMKAFCVXMFH-GLLQMLDFNA-N
InChICode InChI=1S/C27H32O16/c1-11(28)14-4-3-13(38-2)7-17(14)42-25-22(34)21(33)20(32)18(43-25)8-39-26-23(35)27(37,10-41-26)9-40-24(36)12-5-15(29)19(31)16(30)6-12/h3-7,18,20-23,25-26,29-35,37H,8-10H2,1-2H3/t18-,20-,21+,22-,23+,25-,26-,27-/m1/s1
SMILES [C@@H]1([C@@H]([C@H]([C@@H]([C@H](O1)CO[C@H]1[C@@H]([C@](CO1)(COC(=O)c1cc(c(c(c1)O)O)O)O)O)O)O)O)Oc1c(C(=O)C)ccc(c1)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePaeoniaceaePaeonia moutan Ref.
PlantaePaeoniaceaePaeonia suffruticosa ANDREWS Ref.
zoom in



OrganismPaeonia moutan
ReferenceYoshikawa, et al., Chem Pharm Bull, 40, (1992), 2248