input word = C00005783

Metabolite InformationStructural formula
Name Limocitrol 3-glucoside
Formula C24H26O14
Mw 538.13225554
CAS RN 77133-42-7
C_ID C00005783 ,
InChIKey PRBUAZIWXABBBW-SSOWEDBPNA-N
InChICode InChI=1S/C24H26O14/c1-33-10-6-8(4-5-9(10)26)19-23(38-24-17(31)16(30)13(27)11(7-25)36-24)15(29)12-14(28)21(34-2)18(32)22(35-3)20(12)37-19/h4-6,11,13,16-17,24-28,30-32H,7H2,1-3H3/t11-,13-,16+,17-,24+/m1/s1
SMILES c1(c(c(c2c(c1OC)oc(c(c2=O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)c1ccc(c(c1)OC)O)O)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePrimulaceaePrimula officinalis Ref.
PlantaeRutaceaeCitrus japonica Ref.
PlantaeRutaceaeCitrus limon Ref.
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