input word = C00002975

Metabolite InformationStructural formula
Name Swertianolin
Formula C20H20O11
Mw 436.10056148
CAS RN 23445-00-3
C_ID C00002975 ,
InChIKey XMVBNLMKPMPWAX-NVODBRQUNA-N
InChICode InChI=1S/C20H20O11/c1-28-7-4-9(23)13-11(5-7)29-19-8(22)2-3-10(14(19)16(13)25)30-20-18(27)17(26)15(24)12(6-21)31-20/h2-5,12,15,17-18,20-24,26-27H,6H2,1H3/t12-,15-,17+,18-,20-/m1/s1
SMILES c1cc(c2c(c1O)oc1c(c2=O)c(cc(c1)OC)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeGentianaceaeGentiana campestris Ref.
PlantaeGentianaceaeGentiana germanica Ref.
PlantaeGentianaceaeGentiana ramosa Ref.
PlantaeGentianaceaeSwertia calycina Ref.
PlantaeGentianaceaeSwertia japonica Ref.
PlantaeGentianaceaeSwertia perennis Ref.
PlantaeGentianaceaeSwertia purpurascens Ref.
PlantaeGentianaceaeSwertia purpurescens Ref.
PlantaeGentianaceaeSwertia tosaensis Ref.
zoom in