input word = C00039729

Metabolite InformationStructural formula
Name Mandarone A
Formula C20H26O3
Mw 314.1881947
CAS RN 61494-73-3
C_ID C00039729 ,
InChIKey VWUIHEHESVHLRX-RSGSQYTANA-N
InChICode InChI=1S/C20H26O3/c1-11(2)12-8-13-14(9-15(12)21)20(5)7-6-18(23)19(3,4)17(20)10-16(13)22/h8-9,11,17,21H,6-7,10H2,1-5H3/t17-,20-/m1/s1
SMILES CC(C)c1cc2c(cc1O)[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1CC2=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeClerodendrum mandarinorum Diels Ref.
PlantaeMeliaceaeAzadirachta indica Ref.
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