input word = C00054216

Metabolite InformationStructural formula
Name (+)-Didehydroarctigenin
Formula C21H22O6
Mw 370.14163844
CAS RN 887281-31-4
C_ID C00054216
InChIKey MHLQLQUSZZCRFB-INQNZLQJSA-N
InChICode InChI=1S/C21H22O6/c1-24-18-7-5-13(11-20(18)26-3)8-15-12-27-21(23)16(15)9-14-4-6-17(22)19(10-14)25-2/h4-7,9-11,15,22H,8,12H2,1-3H3/b16-9+/t15-/m1/s1
SMILES COc1cc(/C=C2/C(=O)OC[C@H]2Cc2ccc(OC)c(OC)c2)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeArctium lappa Ref.
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