input word = C00003381

Metabolite InformationStructural formula
Name Tutin
Formula C15H18O6
Mw 294.11033831
CAS RN 2571-22-4
C_ID C00003381 ,
InChIKey CCAZWUJBLXKBAY-JGIOUNRTNA-N
InChICode InChI=1S/C15H18O6/c1-5(2)6-7-12(17)20-8(6)9(16)13(3)14(4-19-14)10-11(21-10)15(7,13)18/h6-11,16,18H,1,4H2,2-3H3/t6-,7+,8+,9+,10+,11-,13-,14+,15-/m0/s1
SMILES [C@H]1([C@H]2[C@H]([C@@H]([C@]3([C@@]1([C@]1([C@H]4[C@@H]3O4)CO1)C)O)C(=O)O2)C(=C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnacardiaceaeToxicodendron capense Ref.
PlantaeCoriariaceaeCoriaria angustissima Ref.
PlantaeCoriariaceaeCoriaria japonica Ref.
PlantaeCoriariaceaeCoriaria sinica Ref.
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OrganismToxicodendron capense
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter51