input word = C00034862

Metabolite InformationStructural formula
Name Isobutyryl helenalin
Formula C19H24O5
Mw 332.16237388
CAS RN 53658-84-7
C_ID C00034862 ,
InChIKey SKAOENNHESXSCC-IPGCPCIKNA-N
InChICode InChI=1S/C19H24O5/c1-9(2)17(21)24-16-15-11(4)18(22)23-13(15)8-10(3)12-6-7-14(20)19(12,16)5/h6-7,9-10,12-13,15-16H,4,8H2,1-3,5H3/t10-,12+,13-,15+,16+,19?/m1/s1
SMILES C=C1C(=O)O[C@@H]2C[C@@H](C)[C@@H]3C=CC(=O)[C@@]3(C)[C@@H](OC(=O)C(C)C)[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeArnica montana cv.ARBO Ref.
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