(Q27120842)

CHEBI:47892 (English)

4-O-beta-D-glucosyl-trans-4-coumarate

6 October 2016

stereoisomer of

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₅H₁₇O₈⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

C1=CC(=CC=C1C=CC(=O)[O-])OC2C(C(C(C(O2)CO)O)O)O

1 reference

CHEBI:47892 (English)

6 October 2016

isomeric SMILES

C1=CC(=CC=C1/C=C\C(=O)[O-])O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O

1 reference

CHEBI:47892 (English)

InChI=1S/C15H18O8/c16-7-10-12(19)13(20)14(21)15(23-10)22-9-4-1-8(2-5-9)3-6-11(17)18/h1-6,10,12-16,19-21H,7H2,(H,17,18)/p-1/b6-3-/t10-,12-,13+,14-,15-/m1/s1

6 October 2016

Identifiers

InChI

1 reference

CHEBI:47892 (English)

LJFYQZQUAULRDF-LSSWKVNRSA-M

6 October 2016

InChIKey

2 references

CHEBI:47892 (English)

6 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(2Z)-3-[4-(beta-D-Glucopyranosyloxy)phenyl]acrylate (English)

6 October 2016

1 reference

CHEBI:47892 (English)

6 October 2016

ChEBI ID

47892

mapping relation type

1 reference

4'-O-beta-D-glucosyl-cis-p-coumarate (English)

6 October 2016

1 reference

1 reference

4'-O-beta-D-glucosyl-cis-p-coumarate (English)