input word = C00002808

Metabolite InformationStructural formula
Name Coleon A
(-)-Coleon A
Coleone A
Formula C20H22O6
Mw 358.14163844
CAS RN 1984-44-7
C_ID C00002808 ,
InChIKey WKRCSOAPKREAOF-CMCQBFCENA-N
InChICode InChI=1S/C20H22O6/c1-6-7-20(5)13-9(4)11-12(17(24)18(13)26-19(20)25)14(21)10(8(2)3)15(22)16(11)23/h6,8,19,22,24-25H,1,7H2,2-5H3/t19-,20-/m1/s1
SMILES c12c(c(c3c(c1C)C(=O)C(=C(C3=O)C(C)C)O)O)O[C@H]([C@@]2(CC=C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataePlectranthus saccatus Benth. Ref.
PlantaeLamiaceaeColeus igniarius Ref.
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OrganismColeus igniarius
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter43