input word = C00011843

Metabolite InformationStructural formula
Name (+)-Caleine E
Calein E
Formula C19H24O6
Mw 348.1572885
CAS RN 110300-73-7
C_ID C00011843 ,
InChIKey RWWQWKJSBZYQNT-IYVWHPRQNA-N
InChICode InChI=1S/C19H24O6/c1-10(2)17(21)25-14-9-19(5,23)15(20)7-6-11(3)8-13-16(14)12(4)18(22)24-13/h6-7,11,13-14,16,23H,1,4,8-9H2,2-3,5H3/b7-6-/t11-,13+,14+,16-,19-/m0/s1
SMILES C\1=C\C(=O)[C@](C[C@H]([C@@H]2[C@@H](C[C@H]1C)OC(=O)C2=C)OC(=O)C(=C)C)(O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCalea zacatechichi Ref.
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