input word = C00026980

Metabolite InformationStructural formula
Name Calanthoside
Calanthoside A
Glucoindican
Formula C20H27NO11
Mw 457.15841071
CAS RN 209465-67-8
C_ID C00026980 ,
InChIKey IBGZNOPZUVZSEJ-PUUQAFCKNA-N
InChICode InChI=1S/C20H27NO11/c22-6-11-13(23)15(25)17(27)19(31-11)29-7-12-14(24)16(26)18(28)20(32-12)30-10-5-21-9-4-2-1-3-8(9)10/h1-5,11-28H,6-7H2/t11-,12-,13-,14-,15+,16+,17-,18-,19-,20-/m1/s1
SMILES c1ccc2c(c1)[nH]cc2O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeOrchidaceaeCalanthe discolor Lindl Ref.
PlantaeOrchidaceaeCalanthe liukiuensis Schltr Ref.
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