input word = C00039472

Metabolite InformationStructural formula
Name Itoside M
(-)-Itoside M
Formula C12H20O7
Mw 276.12090299
CAS RN 1016275-82-3
C_ID C00039472 ,
InChIKey AEDRDGQOEJEODM-WVPNZTLXNA-N
InChICode InChI=1S/C12H20O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-4-2-1-3-6(7)14/h2,4,6-17H,1,3,5H2/t6-,7+,8+,9-,10-,11+,12-/m0/s1
SMILES OC[C@H]1O[C@@H](O[C@@H]2C=CCC[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFlacourtiaceaeItoa orientalis Ref.
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OrganismItoa orientalis
ReferenceChai,J.Nat.Prod.,71,(2008),814