input word = C00021852

Metabolite InformationStructural formula
Name alpha-Santalene-12-oic acid
alpha-santalenoic acid
Formula C15H22O2
Mw 234.16197995
CAS RN 74642-79-8
C_ID C00021852 ,
InChIKey NZSCHTYUGUVLHG-WEVVVXLNNA-N
InChICode InChI=1S/C15H22O2/c1-9(13(16)17)5-4-6-14(2)10-7-11-12(8-10)15(11,14)3/h5,10-12H,4,6-8H2,1-3H3,(H,16,17)/b9-5+/t10-,11+,12-,14-,15+/m1/s1
SMILES [C@@H]12[C@]3([C@@H]1C[C@@H](C2)[C@@]3(C)CC/C=C(/C(=O)O)\C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAyapana amygdalina Ref.
PlantaeSantalaceaeSantalum album Ref.
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