input word = C00064384

Metabolite InformationStructural formula
Name Aloesaponol I
Formula C17H16O6
Mw 316.09468824
CAS RN 53254-81-2
C_ID C00064384
InChIKey HMBXOSGHDRHNNU-SNVBAGLBSA-N
InChICode InChI=1S/C17H16O6/c1-7-13-9(5-11(19)14(7)17(22)23-2)3-8-4-10(18)6-12(20)15(8)16(13)21/h3,5,10,18-19,21H,4,6H2,1-2H3/t10-/m1/s1
SMILES COC(=O)c1c(O)cc2cc3c(c(O)c2c1C)C(=O)CC(O)C3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsphodelaceaeAloe barbadensis Ref.
PlantaeAsphodelaceaeAloe megalacantha Ref.
PlantaeAsphodelaceaeAloe sabaea Ref.
PlantaeAsphodelaceaeAloe saponaria Ref.
PlantaeAsphodelaceaeAloe turkanensis Ref.
PlantaeAsphodelaceaeAloe vera Ref.
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