input word = C00007885

Metabolite InformationStructural formula
Name Neosakuranin
Formula C22H24O10
Mw 448.13694699
CAS RN 31187-54-9
C_ID C00007885 ,
InChIKey MNYVBVCMMNPLJI-LHJGPOCMNA-N
InChICode InChI=1S/C22H24O10/c1-30-13-8-15(26)18(14(25)7-4-11-2-5-12(24)6-3-11)16(9-13)31-22-21(29)20(28)19(27)17(10-23)32-22/h2-9,17,19-24,26-29H,10H2,1H3/b7-4+/t17-,19-,20+,21-,22-/m1/s1
SMILES COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(O[C@@H]2OC(CO)[C@@H](O)[C@H](O)C2O)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAgeratina havanensis Ref.
PlantaeJuglandaceaeJuglans nigra Ref.
PlantaeRosaceaePrunus cerasoides Ref.
PlantaeRosaceaePrunus jamasakura Ref.
PlantaeRosaceaePrunus puddum Ref.
PlantaeSalicaceaePopulus sieboldii Ref.
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