input word = C00017421

Metabolite InformationStructural formula
Name Isoadenostylone
Formula C19H24O4
Mw 316.16745925
CAS RN 18883-10-8
C_ID C00017421 ,
InChIKey ZQIYCDQVROXNHS-STUFPIMLNA-N
InChICode InChI=1S/C19H24O4/c1-10(2)18(21)23-17-14-11(3)9-22-16(14)15(20)13-8-6-7-12(4)19(13,17)5/h6,8-10,12-13,17H,7H2,1-5H3/t12-,13+,17+,19+/m0/s1
SMILES C1=C[C@H]2[C@@]([C@H](C1)C)([C@@H](c1c(C2=O)occ1C)OC(=O)C(C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAdenostyles alliariae Ref.
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OrganismAdenostyles alliariae
ReferenceSamek,Collect.Czech.Chem.Commun.,32,(1969),2292