input word = C00047204

Metabolite InformationStructural formula
Name Callicarpic acid B
(-)-Callicarpic acid B
Formula C20H26O4
Mw 330.18310932
CAS RN 1130124-83-2
C_ID C00047204 ,
InChIKey GPJZKLLQWSDGSG-SBUNUNJWNA-N
InChICode InChI=1S/C20H26O4/c1-11(2)14-10-16(21)18-13(19(14)24)6-7-15(12(3)4)20(18,5)9-8-17(22)23/h10-11,15H,3,6-9H2,1-2,4-5H3,(H,22,23)/t15-,20-/m0/s1
SMILES [C@H]1(CCC2=C([C@]1(CCC(=O)O)C)C(=O)C=C(C2=O)C(C)C)C(=C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeCallicarpa pilosissima Ref.
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