input word = C00010961

Metabolite InformationStructural formula
Name Schizonepetoside B
Formula C16H26O7
Mw 330.16785319
CAS RN 78897-60-6
C_ID C00010961 ,
InChIKey ZJJQMILJDZZZHQ-FKWUPUONNA-N
InChICode InChI=1S/C16H26O7/c1-8-3-4-9(10(18)5-8)16(2)7-21-15-14(23-16)13(20)12(19)11(6-17)22-15/h8-9,11-15,17,19-20H,3-7H2,1-2H3/t8-,9-,11-,12-,13+,14+,15-,16-/m1/s1
SMILES CC1CCC(C2(C)CO[C@@H]3OC(CO)[C@@H](O)[C@H](O)C3O2)C(=O)C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeSchizonepeta tenuifolia Ref.
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