input word = C00002115

Metabolite InformationStructural formula
Name Senampeline A
Formula C25H31NO8
Mw 473.20496697
CAS RN 62787-00-2
C_ID C00002115 ,
InChIKey DZBWFFPQOFEYIE-OKYWYXCKNA-N
InChICode InChI=1S/C25H31NO8/c1-7-16(5)24(29)34-20-12-21(33-17(6)27)26-10-9-19(23(20)26)14-32-25(30)18(8-2)13-31-22(28)11-15(3)4/h7-11,20-21H,12-14H2,1-6H3/b16-7+,18-8+/t20-,21+/m1/s1
SMILES c12n(ccc1COC(=O)/C(=C/C)/COC(=O)C=C(C)C)[C@H](C[C@H]2OC(=O)/C(=C/C)/C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeSenecio aetnensis Ref.
PlantaeAsteraceaeSenecio aucheri Ref.
PlantaeAsteraceaeSenecio pterophorus Ref.
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OrganismSenecio aetnensis
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter26