input word = C00032578

Metabolite InformationStructural formula
Name 1,2-Di-O-(E)-caffeoyl-beta-D-glucopyranose
Formula C24H24O12
Mw 504.12677623
CAS RN 359819-37-7
C_ID C00032578 ,
InChIKey SBHXVBQFPRWFAC-WTBRMCJANA-N
InChICode InChI=1S/C24H24O12/c25-11-18-21(32)22(33)23(35-19(30)7-3-12-1-5-14(26)16(28)9-12)24(34-18)36-20(31)8-4-13-2-6-15(27)17(29)10-13/h1-10,18,21-29,32-33H,11H2/b7-3+,8-4+/t18-,21-,22+,23-,24+/m1/s1
SMILES [C@H]1([C@H]([C@@H]([C@H](O[C@H]1OC(=O)/C=C/c1cc(c(cc1)O)O)CO)O)O)OC(=O)/C=C/c1cc(c(cc1)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBalanophoraceaeBalanophora japonica Ref.
zoom in