input word = C00054154

Metabolite InformationStructural formula
Name Coriandrone B
Formula C16H20O5
Mw 292.13107375
CAS RN 139906-04-0
C_ID C00054154
InChIKey BWHXOOBBSCGLBC-QPUJVOFHSA-N
InChICode InChI=1S/C16H20O5/c1-8-5-9-6-11(19-4)10-7-12(17)16(2,3)21-14(10)13(9)15(18)20-8/h6,8,12,17H,5,7H2,1-4H3/t8-,12+/m0/s1
SMILES COc1cc2c(c3c1C[C@@H](O)C(C)(C)O3)C(=O)O[C@@H](C)C2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeCoriandrum sativum Ref.
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