input word = C00044205

Metabolite InformationStructural formula
Name Isosengulone
Formula C32H22O9
Mw 550.1263823
CAS RN 173693-55-5
C_ID C00044205 ,
InChIKey FJWJLZZKPGNFMF-UHFFFAOYSA-N
InChICode InChI=1S/C32H22O9/c1-12-5-18-24(22(35)6-12)31(38)27-19(30(18)37)11-23(41-4)28(32(27)39)25-16-8-14(40-3)9-21(34)15(16)10-17-20(33)7-13(2)29(36)26(17)25/h5-11,34-35,39H,1-4H3
SMILES COc1cc(O)c2cc3c(c(-c4c(OC)cc5c(c4O)C(=O)c4c(O)cc(C)cc4C5=O)c2c1)C(=O)C(C)=CC3=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeSenna sophera Ref.
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