input word = C00012839

Metabolite InformationStructural formula
Name (2S-cis)-1,2,3,4,4a,5,6,7-Octahydro-4a,8-dimethyl-alpha-methylene-4-oxo-2-naphthaleneacetic acid
Formula C15H20O3
Mw 248.1412445
CAS RN 111394-35-5
C_ID C00012839 ,
InChIKey NDUKUJGEYDDPGK-UXYSATNRNA-N
InChICode InChI=1S/C15H20O3/c1-9-5-4-6-15(3)12(9)7-11(8-13(15)16)10(2)14(17)18/h11H,2,4-8H2,1,3H3,(H,17,18)/t11-,15-/m0/s1
SMILES C1(=C2[C@](CCC1)(C(=O)C[C@H](C2)C(=C)C(=O)O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeArtemisia tournefortiana Ref.
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