input word = C00063218

Metabolite InformationStructural formula
Name 5-[(2S,3S)-2,3-Dihydro-3-(hydroxymethyl)-7-[(1E)-3-hydroxy-1-propen-1-yl]-5-methoxy-1,4-benzodioxin-2-yl]-3-methoxy-1,2-benzenediol
Formula C20H22O8
Mw 390.13146768
CAS RN 864079-22-1
C_ID C00063218
InChIKey GJTCFMOIDDENBS-PABLAQFASA-N
InChICode InChI=1S/C20H22O8/c1-25-14-9-12(8-13(23)18(14)24)19-17(10-22)28-20-15(26-2)6-11(4-3-5-21)7-16(20)27-19/h3-4,6-9,17,19,21-24H,5,10H2,1-2H3/b4-3+/t17-,19-/m0/s1
SMILES COc1cc(C2Oc3cc(C=CCO)cc(OC)c3OC2CO)cc(O)c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSantalaceaeSantalum album Ref.
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