input word = C00006112

Metabolite InformationStructural formula
Name Aervanone
(2S)-8-beta-D-Galactopyranosyl-2,3-dihydro-7-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
Formula C21H22O9
Mw 418.1263823
CAS RN 75775-37-0
C_ID C00006112 ,
InChIKey WSJDTGQWBASAKN-ADUUFOGDNA-N
InChICode InChI=1S/C21H22O9/c22-8-15-17(26)18(27)19(28)21(30-15)16-12(24)6-5-11-13(25)7-14(29-20(11)16)9-1-3-10(23)4-2-9/h1-6,14-15,17-19,21-24,26-28H,7-8H2/t14-,15-,17-,18-,19+,21-/m0/s1
SMILES c1(ccc2c(c1[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)CO)O)O)O)O[C@@H](CC2=O)c1ccc(cc1)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAmaranthaceaeAerva persica Ref.
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