input word = C00014477

Metabolite InformationStructural formula
Name Isodehydrocycloxanthohumol hydrate
6'',6''-Dimethyl-4'',5''-dihydropyrano[2'',3'':4',3']-4,2'-dihydroxy-6'-methoxychalcone
Formula C21H22O5
Mw 354.14672381
CAS RN 250603-94-2
C_ID C00014477 ,
InChIKey DCKAGTTYZUDEDQ-RMKNXTFCSA-N
InChICode InChI=1S/C21H22O5/c1-21(2)11-10-15-17(26-21)12-18(25-3)19(20(15)24)16(23)9-6-13-4-7-14(22)8-5-13/h4-9,12,22,24H,10-11H2,1-3H3/b9-6+
SMILES c1(ccc(cc1)/C=C/C(=O)c1c(c2c(cc1OC)OC(CC2)(C)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCannabaceaeHumulus lupulus Ref.
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