input word = C00056176

Metabolite InformationStructural formula
Name Tomentin B
Formula C26H32O7
Mw 456.21480338
CAS RN 1440897-99-3
C_ID C00056176
InChIKey JKVINBILQDMNEH-DQUNLGLBSA-N
InChICode InChI=1S/C26H32O7/c1-25(2,30)9-5-10-26(3)11-8-16-21(33-26)14-22-23(24(16)29)18(28)13-20(32-22)15-6-7-19(31-4)17(27)12-15/h6-7,12,14,20,27,29-30H,5,8-11,13H2,1-4H3/t20-,26?/m0/s1
SMILES COc1ccc([C@@H]2CC(=O)c3c(cc4c(c3O)CCC(C)(CCCC(C)(C)O)O4)O2)cc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePaulowniaceaePaulownia tomentosa Ref.
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OrganismPaulownia tomentosa
ReferenceMani, J. S. et al., Virus Research, 284, (2020), 197989.