input word = C00012946

Metabolite InformationStructural formula
Name [4aS-(4aalpha,5alpha,8abeta,9abeta)]-4a,6,7,8a,9,9a-Hexahydro-3,5,8a-trimethylnaphtho[2,3-b]furan-2,8(4H,5H)-dione
Formula C15H20O3
Mw 248.1412445
CAS RN 108044-20-8
C_ID C00012946 ,
InChIKey YTCKQTWKHOQCJV-QDMLYTKYNA-N
InChICode InChI=1S/C15H20O3/c1-8-4-5-13(16)15(3)7-12-10(6-11(8)15)9(2)14(17)18-12/h8,11-12H,4-7H2,1-3H3/t8-,11+,12+,15-/m1/s1
SMILES [C@@H]1([C@H]2[C@](C(=O)CC1)(C[C@H]1C(=C(C(=O)O1)C)C2)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeSmyrnium galaticum Ref.
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