input word = C00031163

Metabolite InformationStructural formula
Name Rhusemialin A
(-)-Rhusemialin A
Formula C31H34O11
Mw 582.21011193
CAS RN 946852-22-8
C_ID C00031163 ,
InChIKey MFFDBMCFAFUUKG-QUBIHGDDNA-N
InChICode InChI=1S/C31H34O11/c1-38-23-12-18(13-24(39-2)29(23)36)27-20(15-42-26(35)8-6-16-5-7-21(33)22(34)9-16)19(14-32)10-17-11-25(40-3)30(37)31(41-4)28(17)27/h5-9,11-13,19-20,27,32-34,36-37H,10,14-15H2,1-4H3/b8-6+/t19-,20-,27+/m0/s1
SMILES COc1cc([C@H]2c3c(cc(OC)c(O)c3OC)C[C@@H](CO)[C@@H]2COC(=O)/C=C/c2ccc(O)c(O)c2)cc(OC)c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnacardiaceaeRhus semialata Ref.
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