input word = C00035553

Metabolite InformationStructural formula
Name Capitellataquinone A
(-)-Capitellataquinone A
Formula C20H18O6
Mw 354.11033831
CAS RN 861664-61-1
C_ID C00035553 ,
InChIKey XTQYMYODVMISSX-UHFFFAOYNA-N
InChICode InChI=1S/C20H18O6/c1-20(2,25)14-7-12-15-11(6-9(8-21)19(12)26-14)18(24)16-10(17(15)23)4-3-5-13(16)22/h3-6,14,21-22,25H,7-8H2,1-2H3/t14-/m1/s1
SMILES C1(=O)c2c(C(=O)c3c1cc(c1c3C[C@@H](O1)C(C)(O)C)CO)cccc2O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeHedyotis capitellata Ref.
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