Molecule

(2R)-3-(3,4-dihydroxyphenyl)-2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxypropanoic acid

Chemical Information

17 Related Dataset(s) ⌄

rosmarinic acid.aptjmod

rosmarinic acid.cosy

rosmarinic acid.hmbc

rosmarinic acid.hsqc

rosmarinic acid.noesy

Rosmarinic acid; LC-ESI-QQ; MS2

Rosmarinic acid; LC-ESI-QTOF; MS2; CE: 10eV; R=7000; [M-H]-

Rosmarinic acid; LC-ESI-QTOF; MS2; CE: 20eV; R=7000; [M-H]-

Rosmarinic acid; LC-ESI-QTOF; MS2; CE: 40eV; R=7000; [M-H]-

Rosmarinic acid; LC-ESI-QTOF; MS2; CE:30 V; [2M+Na]+

Rosmarinic acid; LC-ESI-QTOF; MS2; CE:30 V; [2M-H]-

Rosmarinic acid; LC-ESI-QTOF; MS2; CE:30 V; [M-H]-

Rosmarinic acid; LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [2M-H]-

Rosmarinic acid; LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M+H]+

Rosmarinic acid; LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M+Na]+

Rosmarinic acid; LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-

Rosmarinic acid; LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-

Metadata Information

Field	Value
NFDI4Chem Molecule ID	nfdi4chem-mol6539
Source
Alternate Name

Field	Value
No additional information available for this Dataset.

Data-Source Molecule ID	Data-Source
DB16865	drugbank
CHEBI:50371	chebi
ROA	rcsb_pdb
CHEMBL324842	chembl
1650675	surechembl
29438187	surechembl
29453379	surechembl
30521740	surechembl
5281792	pubchem
MQE6XG29YI	fdasrs
ROA - Ideal conformer	pdbe
PD020694	probes_and_drugs
147139	brenda
2035	brenda
45884	brenda
HMDB0003572	hmdb
Molport-001-740-341	molport
50133496	bindingdb
The data in this table is sourced from UniChem at EBI.