input word = C00021128

Metabolite InformationStructural formula
Name Arnicolide C
Formula C19H26O5
Mw 334.17802394
CAS RN 34532-67-7
C_ID C00021128 ,
InChIKey WKUOPGZYLRFCHJ-AOWKIOSNNA-N
InChICode InChI=1S/C19H26O5/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/h6-7,9-13,15-16H,8H2,1-5H3/t10-,11+,12+,13-,15+,16+,19+/m1/s1
SMILES [C@@H]12[C@]([C@H]([C@@H]3[C@@H](C[C@H]1C)OC(=O)[C@H]3C)OC(=O)C(C)C)(C(=O)C=C2)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeArnica montana Ref.
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