input word = C00036513

Metabolite InformationStructural formula
Name 3,4-Dihydroaucubin
Formula C15H24O9
Mw 348.14203237
CAS RN 82426-96-8
C_ID C00036513 ,
InChIKey OOJZWXCTDBXCJY-UHFFFAOYNA-N
InChICode InChI=1S/C15H24O9/c16-4-6-3-8(18)7-1-2-22-14(10(6)7)24-15-13(21)12(20)11(19)9(5-17)23-15/h3,7-21H,1-2,4-5H2/t7-,8-,9+,10+,11-,12-,13+,14-,15+/m0/s1
SMILES O1CC[C@@H]2[C@H]([C@@H]1O[C@@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)C(=C[C@@H]2O)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePlantaginaceaePlantago subulata Ref.
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