input word = C00023546

Metabolite InformationStructural formula
Name 12-Epiconycephaloide
Formula C20H20O5
Mw 340.13107375
CAS RN 97588-24-4
C_ID C00023546 ,
InChIKey JSJGGYMCEWCMES-WMLZZKCZNA-N
InChICode InChI=1S/C20H20O5/c1-19-8-16(12-5-6-23-9-12)24-10-14(19)15(21)7-20-11-25-18(22)13(20)3-2-4-17(19)20/h3,5-6,9-10,16-17H,2,4,7-8,11H2,1H3/t16-,17-,19+,20-/m1/s1
SMILES C1C=C2[C@]3([C@H](C1)[C@@]1(C(=CO[C@H](C1)c1cocc1)C(=O)C3)C)COC2=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBaccharis scoparia Ref.
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