input word = C00012967

Metabolite InformationStructural formula
Name Tanacetin
[3aS-(3aalpha,5abeta,6beta,9aalpha,9bbeta)]-Decahydro-6,9a-dihydroxy-5a-methyl-3,9-bis(methylene)-naphtho[1,2-b]furan-2(3H)-one
Formula C15H20O4
Mw 264.13615913
CAS RN 1401-54-3
C_ID C00012967 ,
InChIKey CFUWPZZLCJXNSQ-INEVTKCQNA-N
InChICode InChI=1S/C15H20O4/c1-8-4-5-11(16)14(3)7-6-10-9(2)13(17)19-12(10)15(8,14)18/h10-12,16,18H,1-2,4-7H2,3H3/t10-,11+,12-,14-,15-/m0/s1
SMILES [C@@H]1([C@]2([C@](C(=C)CC1)([C@@H]1[C@@H](CC2)C(=C)C(=O)O1)O)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeTanacetum vulgare Ref.
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