input word = C00029293

Metabolite InformationStructural formula
Name (+)-Abscisyl beta-D-glucopyranoside
Formula C21H30O9
Mw 426.18898256
CAS RN 21414-42-6
C_ID C00029293 ,
InChIKey HLVPIMVSSMJFPS-XMYHQDGWNA-N
InChICode InChI=1S/C21H30O9/c1-11(5-6-21(28)12(2)8-13(23)9-20(21,3)4)7-15(24)30-19-18(27)17(26)16(25)14(10-22)29-19/h5-8,14,16-19,22,25-28H,9-10H2,1-4H3/b6-5+,11-7-/t14-,16-,17+,18-,19+,21-/m1/s1
SMILES [C@@H]1([C@@H]([C@H](O[C@H]([C@@H]1O)OC(=O)/C=C(/C)\C=C\[C@]1(C(=CC(=O)CC1(C)C)C)O)CO)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeSalacia chinensis Ref.
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