input word = C00032590

Metabolite InformationStructural formula
Name 1,3-Di-O-(E)-Caffeoyl-beta-D-glucopyranose
(-)-1,3-Di-O-(E)-Caffeoyl-beta-D-glucopyranose
Formula C24H24O12
Mw 504.12677623
CAS RN 359819-38-8
C_ID C00032590 ,
InChIKey KIODQZXMNGIVNL-RZXOOCENNA-N
InChICode InChI=1S/C24H24O12/c25-11-18-21(32)23(35-19(30)7-3-12-1-5-14(26)16(28)9-12)22(33)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 O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBalanophoraceaeBalanophora japonica Ref.
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