input word = C00007160

Metabolite InformationStructural formula
Name 3,4-Dihydroxyrottlerin
Formula C30H28O10
Mw 548.16824712
CAS RN 24650-82-6
C_ID C00007160 ,
InChIKey LXWIYZXWHIMUOX-SOFGYWHQSA-N
InChICode InChI=1S/C30H28O10/c1-13-24(35)17(27(38)22(14(2)31)25(13)36)12-18-26(37)16-9-10-30(3,4)40-29(16)23(28(18)39)20(33)8-6-15-5-7-19(32)21(34)11-15/h5-11,32,34-39H,12H2,1-4H3/b8-6+
SMILES CC(=O)c1c(O)c(C)c(O)c(Cc2c(O)c3c(c(C(=O)/C=C/c4ccc(O)c(O)c4)c2O)OC(C)(C)C=C3)c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeRottlera tinctoria Ref.
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