input word = C00031617

Metabolite InformationStructural formula
Name Balanophonin 4-O-beta-D-glucopyranoside
Dehydrodiconiferyl alcohol glucoside
(-)-Dehydrodiconiferyl alcohol-4-beta-D-glucoside
Formula C26H30O11
Mw 518.1788118
CAS RN 215319-51-0
C_ID C00031617 ,
InChIKey RPOPBMQXJDSYEK-TUUHSZDFNA-N
InChICode InChI=1S/C26H30O11/c1-33-18-10-14(5-6-17(18)35-26-23(32)22(31)21(30)20(12-29)36-26)24-16(11-28)15-8-13(4-3-7-27)9-19(34-2)25(15)37-24/h3-10,16,20-24,26,28-32H,11-12H2,1-2H3/b4-3+/t16-,20-,21-,22+,23-,24+,26-/m1/s1
SMILES c1c(cc2c(c1OC)O[C@H]([C@@H]2CO)c1ccc(c(c1)OC)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)/C=C/C=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBalanophoraceaeBalanophora japonica Ref.
PlantaeLinaceaeLinum usitatissimum L. Ref.
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