input word = C00054589

Metabolite InformationStructural formula
Name Aloesol
7-Hydroxy-2-(2-hydroxypropyl)-5-methyl-4H-1-benzopyran-4-one
Formula C13H14O4
Mw 234.08920894
CAS RN 94356-35-1
C_ID C00054589
InChIKey ZYCNQWOKCMJKEZ-QMMMGPOBSA-N
InChICode InChI=1S/C13H14O4/c1-7-3-9(15)5-12-13(7)11(16)6-10(17-12)4-8(2)14/h3,5-6,8,14-15H,4H2,1-2H3/t8-/m0/s1
SMILES Cc1cc(O)cc2oc(C[C@H](C)O)cc(=O)c12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsphodelaceaeAloe spp. Ref.
PlantaeAsphodelaceaeAloe vera Ref.
--Chinese rhubarb Ref.
zoom in