input word = C00012727

Metabolite InformationStructural formula
Name Costic acid
Costus acid
Formula C15H22O2
Mw 234.16197995
CAS RN 3650-43-9
C_ID C00012727 ,
InChIKey UJQGVDNQDFTTLZ-MEXAAGJUNA-N
InChICode InChI=1S/C15H22O2/c1-10-5-4-7-15(3)8-6-12(9-13(10)15)11(2)14(16)17/h12-13H,1-2,4-9H2,3H3,(H,16,17)/t12-,13+,15-/m1/s1
SMILES C1[C@]2([C@H](C(=C)CC1)C[C@@H](CC2)C(=C)C(=O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAmbrosia ilicifolia Ref.
PlantaeAsteraceaeDittrichia graveolens (L.) GREUTER Ref.
PlantaeAsteraceaeLaggera alata Ref.
PlantaeAsteraceaeSaussurea lappa Ref.
PlantaeLauraceaeMachilus wangchiana Ref.
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