input word = C00014640

Metabolite InformationStructural formula
Name Cinnabarone
3-[2-Hydroxy-5-[3-(2-hydroxy-4-methoxyphenyl)-1-(4-hydroxyphenyl)propyl]-4-methoxyphenyl]-1-(4-hydroxyphenyl)-1-propanone
Formula C32H32O7
Mw 528.21480338
CAS RN 163565-66-0
C_ID C00014640 ,
InChIKey HZJPAKJGVGOXRN-UHFFFAOYNA-N
InChICode InChI=1S/C32H32O7/c1-38-26-14-7-22(30(36)18-26)8-15-27(20-3-10-24(33)11-4-20)28-17-23(31(37)19-32(28)39-2)9-16-29(35)21-5-12-25(34)13-6-21/h3-7,10-14,17-19,27,33-34,36-37H,8-9,15-16H2,1-2H3/t27-/m0/s1
SMILES COc1ccc(CCC(c2ccc(O)cc2)c2cc(CCC(=O)c3ccc(O)cc3)c(O)cc2OC)c(O)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeDracaenaceaeDracaena cinnabari Ref.
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