input word = C00013405

Metabolite InformationStructural formula
Name Dinklagin C
(+)-5,7-Dihydroxy-6-(2-hydroxy-3-methyl-3-butenyl)-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
Formula C20H18O6
Mw 354.11033831
CAS RN 487010-53-7
C_ID C00013405 ,
InChIKey PDONMPUBRSPUSC-UHFFFAOYNA-N
InChICode InChI=1S/C20H18O6/c1-10(2)14(22)7-13-15(23)8-18-19(20(13)25)16(24)9-17(26-18)11-3-5-12(21)6-4-11/h3-6,8-9,14,21-23,25H,1,7H2,2H3/t14-/m0/s1
SMILES c12c(cc(c(c1O)C[C@@H](C(=C)C)O)O)oc(cc2=O)c1ccc(cc1)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMoraceaeDorstenia dinklagii Ref.
PlantaeMoraceaeMaclura pomifera Ref.
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