(Q27105318)

1-Caffeoyl-beta-D-glucose (English)

5 October 2016

chemical formula

C₁₅H₁₈O₉

1 reference

1-Caffeoyl-beta-D-glucose (English)

5 October 2016

canonical SMILES

C1=CC(=C(C=C1C=CC(=O)OC2C(C(C(C(O2)CO)O)O)O)O)O

1 reference

1-Caffeoyl-beta-D-glucose (English)

5 October 2016

isomeric SMILES

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

1 reference

Antioxidant Phenolic Glycosides from Moricandia arvensis

1-Caffeoyl-beta-D-glucose (English)

5 October 2016

3 references

Antioxidant phenolic glycosides from Moricandia arvensis

Antioxidant phenolic glycosides from Moricandia arvensis

Ligustrum obtusifolium

1 reference

Studies on the Constituents of Ligustrum Species. XIII. : Structures of Phenylethanoid Glycosides from the Leaves of Ligustrum obtusifolium SIEB. et ZUCC.

Clematis tashiroi

1 reference

Antioxidant and Anti-Inflammatory Phenolic Glycosides from Clematis tashiroi

Coussarea hydrangeifolia

2 references

Phenylpropanoid glucosides from leaves of Coussarea hydrangeifolia (Rubiaceae).

Phenylpropanoid glucosides from leaves of Coussarea hydrangeifolia (Rubiaceae).

strawberries

1 reference

Hydroxybenzoic and hydroxycinnamic acid derivatives in soft fruits

Ribes nigrum

2 references

High-Performance Liquid Chromatography (HPLC) Analysis of Phenolic Compounds in Berries with Diode Array and Electrospray Ionization Mass Spectrometric (MS) Detection: Ribes Species

Hydroxybenzoic and hydroxycinnamic acid derivatives in soft fruits

Ribes rubrum

1 reference

Hydroxybenzoic and hydroxycinnamic acid derivatives in soft fruits

Ribes uva-crispa

1 reference

Hydroxybenzoic and hydroxycinnamic acid derivatives in soft fruits

Rubus

1 reference

Hydroxybenzoic and hydroxycinnamic acid derivatives in soft fruits

Vaccinium corymbosum

1 reference

Hydroxybenzoic and hydroxycinnamic acid derivatives in soft fruits

Adenocaulon himalaicum

1 reference

Phenolic compounds of Aruncus dioicus and Adenocaulon adhaerescens

Albugo candida

1 reference

Phytoalexins and polar metabolites from the oilseeds canola and rapeseed: differential metabolic responses to the biotroph Albugo candida and to abiotic stress

Aruncus dioicus

1 reference

Phenolic compounds of Aruncus dioicus and Adenocaulon adhaerescens

Balanophora fungosa

2 references

Melanin synthesis inhibitors from Balanophora fungosa

Galloyl and hexahydroxydiphenoyl esters of phenylpropanoid glucosides, phenylpropanoids and phenylpropanoid glucosides from rhizome of Balanophora fungosa

Balanophora harlandii

1 reference

A New Hydrolyzable Tannin fromBalanophora harlandiiwith Radical-Scavenging Activity

Balanophora japonica

1 reference

Caffeoyl, coumaroyl, galloyl, and hexahydroxydiphenoyl glucoses from Balanophora japonica.

Balanophora laxiflora

1 reference

Phenolic constituents from Balanophora laxiflora with DPPH radical-scavenging activity.

Brassica rapa

1 reference

Sinalexin, a phytoalexin from white mustard elicited by destruxin B and Alternaria brassicae

Hypericum perforatum

1 reference

Variation in the composition of the essential oils, phenolic compounds and mineral elements of Hypericum perforatum L. growing in Estonia

Identifiers

InChI

InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1

1 reference

1-Caffeoyl-beta-D-glucose (English)

5 October 2016

2 references

1-Caffeoyl-beta-D-glucose (English)

5 October 2016

ChEBI release 2020-09-01

1 reference

1-caffeoyl-beta-D-glucose (English)

5 October 2016

1 reference

1-O-[(2E)-3-(3,4-Dihydroxyphenyl)-2-propenoyl]-beta-D-glucopyranose (English)

5 October 2016

2 references

1-Caffeoyl-beta-D-glucose (English)

5 October 2016

Reaxys registry number

1295557

1 reference

1-caffeoyl-beta-D-glucose (English)

5 October 2016

ChEBI ID

614

mapping relation type

2 references

1-caffeoyl-beta-D-glucose (English)

5 October 2016

International Chemical Identifier

InChI

InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2/b4-2+/t10-,12-,13+,14-,15+/m1/s1

1 reference

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

CHEMBL482242 (English)

5 October 2016

1 reference

2 references

DSSTOX compound identifier

DTXCID20366039

0 references

Human Metabolome Database ID

HMDB0036937

reason for deprecated rank

cannot be confirmed by other sources

0 references

HMDB0302440

2 references

based on heuristic

inferred from InChIKey

1 reference

1-caffeoyl-beta-D-glucose (English)

5 October 2016

C00059613

2 references

based on heuristic

inferred from InChIKey

1 reference

1-caffeoyl-beta-D-glucose (English)