input word = C00053107

Metabolite InformationStructural formula
Name Bornylferulate
Formula C20H26O4
Mw 330.18310932
CAS RN 55511-07-4
C_ID C00053107
InChIKey PKAIECBWQZFYRP-JNAXZKDPSA-N
InChICode InChI=1S/C20H26O4/c1-19(2)14-9-10-20(19,3)17(12-14)24-18(22)8-6-13-5-7-15(21)16(11-13)23-4/h5-8,11,14,17,21H,9-10,12H2,1-4H3/t14-,17+,20+/m0/s1
SMILES COc1cc(/C=C/C(=O)O[C@@H]2C[C@@H]3CC[C@@]2(C)C3(C)C)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePinaceaePinus koraiensis Ref.
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