input word = C00019836

Metabolite InformationStructural formula
Name 2,3-Dihydro-9-hydroxy-2-[1-(6-feruloyl)-beta-D-glucosyloxy-1-methylethyl]-7H-furo[3,2-g][1]benzopyran-7-one
Formula C30H32O13
Mw 600.18429111
CAS RN 145918-57-6
C_ID C00019836 ,
InChIKey ZHYNJRGCDATHJU-ILDMFNPYNA-N
InChICode InChI=1S/C30H32O13/c1-30(2,20-12-16-11-15-6-9-22(33)42-27(15)26(37)28(16)41-20)43-29-25(36)24(35)23(34)19(40-29)13-39-21(32)8-5-14-4-7-17(31)18(10-14)38-3/h4-11,19-20,23-25,29,31,34-37H,12-13H2,1-3H3/b8-5+/t19-,20+,23-,24+,25-,29+/m1/s1
SMILES COc1cc(/C=C/C(=O)OCC2O[C@@H](OC(C)(C)C3Cc4cc5ccc(=O)oc5c(O)c4O3)C(O)[C@@H](O)[C@@H]2O)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeSkimmia japonica Ref.
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OrganismSkimmia japonica
ReferenceReisch,Phytochem.,31,(1992),4376