input word = C00014058

Metabolite InformationStructural formula
Name Cytisoside 3''-O-beta-D-rhamnopyranoside
Formula C28H32O14
Mw 592.17920573
CAS RN 360562-72-7
C_ID C00014058 ,
InChIKey ROHFXZVXVOFJHV-PXLJWMHVNA-N
InChICode InChI=1S/C28H32O14/c1-10-20(33)22(35)23(36)28(39-10)42-27-21(34)17(9-29)41-26(24(27)37)19-14(31)7-13(30)18-15(32)8-16(40-25(18)19)11-3-5-12(38-2)6-4-11/h3-8,10,17,20-24,26-31,33-37H,9H2,1-2H3/t10-,17-,20-,21+,22+,23-,24+,26-,27-,28-/m0/s1
SMILES c1(oc2c(c(=O)c1)c(cc(c2[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)CO)O)O[C@H]1[C@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)O)O)O)c1ccc(cc1)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraceaeAnthurium versicolor Ref.
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