input word = C00030093

Metabolite InformationStructural formula
Name Deacetylasperulosidic acid
Formula C16H22O11
Mw 390.11621155
CAS RN 14259-55-3
C_ID C00030093 ,
InChIKey ZVXWFPTVHBWJOU-NXOHDJQCNA-N
InChICode InChI=1S/C16H22O11/c17-2-5-1-7(19)10-6(14(23)24)4-25-15(9(5)10)27-16-13(22)12(21)11(20)8(3-18)26-16/h1,4,7-13,15-22H,2-3H2,(H,23,24)/t7-,8-,9-,10+,11+,12+,13-,15+,16+/m1/s1
SMILES O1C=C([C@@H]2[C@H]([C@@H]1O[C@@H]1O[C@@H]([C@@H]([C@@H]([C@H]1O)O)O)CO)C(=C[C@H]2O)CO)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEucommiaceaeEucommia ulmoides Oliv. Ref.
PlantaeRubiaceaeGalium rivale Ref.
PlantaeRubiaceaeLasianthus acuminatissimus MERR. Ref.
PlantaeRubiaceaeMorinda citrifolia L. Ref.
PlantaeRubiaceaeSaprosma scortechinii Ref.
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OrganismMorinda citrifolia L.
ReferenceKamiya,Chem.Pharm.Bull.,53,(2005),1597