input word = C00034181

Metabolite InformationStructural formula
Name Pterogynoside
(-)-Pterogynoside
Formula C29H26O14
Mw 598.13225554
CAS RN 1037034-68-6
C_ID C00034181 ,
InChIKey AYSKZHKNQWJAPA-MVKQCKBGNA-N
InChICode InChI=1S/C29H26O14/c1-11-21(35)26(42-28(38)13-7-17(33)25(39-2)18(34)8-13)23(37)29(40-11)43-27-22(36)20-16(32)9-15(31)10-19(20)41-24(27)12-3-5-14(30)6-4-12/h3-11,21,23,26,29-35,37H,1-2H3/t11-,21-,23+,26+,29-/m0/s1
SMILES COc1c(O)cc(C(=O)O[C@@H]2[C@@H](O)[C@H](C)O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@@H]2O)cc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePiperaceaePiper umbellatum Ref.
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