input word = C00010498

Metabolite InformationStructural formula
Name Ulmoside
Formula C21H32O14
Mw 508.17920573
CAS RN 67708-72-9
C_ID C00010498 ,
InChIKey NOVFAHFRCMKDBE-KLYUKMKGNA-N
InChICode InChI=1S/C21H32O14/c22-4-7-3-9(24)8-1-2-31-19(12(7)8)35-21-18(30)16(28)14(26)11(34-21)6-32-20-17(29)15(27)13(25)10(5-23)33-20/h1-3,8-30H,4-6H2/t8-,9+,10-,11+,12-,13+,14+,15+,16-,17+,18+,19+,20-,21+/m1/s1
SMILES [C@@H]12[C@H]([C@@H](OC=C1)O[C@@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O)CO[C@@H]1O[C@@H]([C@@H]([C@@H]([C@@H]1O)O)O)CO)C(=C[C@@H]2O)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEucommiaceaeEucommia ulmoides Ref.
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