Curcumin

Systematic / IUPAC Name: (1E,6E)-1,7-Bis(4-hydroxy-3-methoxyphenyl)-1,6-heptadiene-3,5-dione

ID: Reference360

Other Names: CI Natural yellow 3;
Curcumin I;
Curcumine;
Curcurmin;
Gelbwurz ; more

Formula: C21H20O6

Class: Endogenous Metabolites Excipients/Additives/Colorants

Spectral Data

Curcumin mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite; Q Exactive Orbitrap
No. of Spectral Trees 6
No. of Spectra 8752
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods ESI; APCI; NSI
Analyzers IT; FT
Last Modification 4/4/2017 9:59:17 AM
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Identificators

InChI InChI=1S/C21H20O6/c1-26-20-11-14(5-9-18(20)24)3-7-16(22)13-17(23)8-4-15-6-10-19(25)21(12-15)27-2/h3-12,24-25H,13H2,1-2H3/b7-3+,8-4+
InChI Key VFLDPWHFBUODDF-FCXRPNKRSA-N
Canonical SMILES COC1=C(C=CC(=C1)/C=C/C(=O)CC(=O)/C=C/C2=CC(=C(C=C2)O)OC)O
CAS 458377
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Other Names CI Natural yellow 3;
Curcumin I;
Curcumine;
Curcurmin;
Gelbwurz;
Haidr;
Halad;
Halud;
Hydrastis;
Kacha haldi;
Merita earth;
Souchet;
Turmeric yellow;
Yellow root;
(1E,6E)-1,7-Bis[4-hydroxy-3-(methyloxy)phenyl]hepta-1,6-diene-3,5-dione;
1,6-Heptadiene-3,5-dione, 1,7-bis(4-hydroxy-3-methoxyphenyl)-, (E,E)-;
1,6-Heptadiene-3,5-dione, 1,7-bis(4-hydroxy-3-methoxyphenyl)-, (1E,6E)-;
1,7-Bis(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione;
1,9-Bis(4-hydroxy-3-methoxyphenyl)-2,7-nonadiene-4,6-dione;
Diferuloylmethane;
Diferulylmethane;
Indian saffron

In Other Databases

KEGG C10443
Wikipedia Curcumin
ChEBI CHEBI:3962
ChemSpider 839564
ChemIDPlus 000458377; 036557161
PubChem 969516
ChEMBL CHEMBL140
HMDb HMDB02269