input word = C00033399

Metabolite InformationStructural formula
Name Suffruticoside D
Formula C27H32O16
Mw 612.16903498
CAS RN 145898-97-1
C_ID C00033399 ,
InChIKey CQQDDGSILZDABB-ILDREYQGNA-N
InChICode InChI=1S/C27H32O16/c1-10(28)13-4-3-12(38-2)7-17(13)41-26-23(36)22(35)24(42-25(37)11-5-14(29)19(32)15(30)6-11)27(43-26)40-9-18-21(34)20(33)16(31)8-39-18/h3-7,16,18,20-24,26-27,29-36H,8-9H2,1-2H3/t16-,18-,20-,21+,22+,23+,24-,26+,27-/m0/s1
SMILES [C@@H]1([C@@H]([C@H]([C@@H](O[C@@H]1OC[C@H]1[C@H]([C@H]([C@H](CO1)O)O)O)Oc1c(ccc(c1)OC)C(=O)C)O)O)OC(=O)c1cc(c(c(c1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePaeoniaceaePaeonia moutan Ref.
PlantaePaeoniaceaePaeonia suffruticosa ANDREWS Ref.
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