input word = C00012360

Metabolite InformationStructural formula
Name Cyathin B5
Tanacin
Tanacin
Formula C20H26O5
Mw 346.17802394
CAS RN 57138-50-8
C_ID C00012360 ,
InChIKey DTOFRQNTRKNUMY-MELQIZNONA-N
InChICode InChI=1S/C20H26O5/c1-6-12(3)18(21)23-14-9-11(2)7-8-16-20(5,25-16)10-15-17(14)13(4)19(22)24-15/h6,9,14-17H,4,7-8,10H2,1-3,5H3/b11-9+,12-6+/t14-,15-,16-,17-,20+/m0/s1
SMILES C\1(=C/[C@@H]([C@H]2[C@H](C[C@@]3([C@H](CC1)O3)C)OC(=O)C2=C)OC(=O)/C(=C/C)/C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeTanacetum pseudoachillea Ref.
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