NP-MRD: Showing NP-Card for Hofmeisterin (NP0078496)

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Record Information

Version

2.0

Created at

2022-04-28 23:34:11 UTC

Updated at

2022-04-28 23:34:11 UTC

NP-MRD ID

NP0078496

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Hofmeisterin

Description

Hofmeisterin belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group. At that time, there were two Chief Court Mistress for the same queen: One as Queen of Sweden at the Swedish royal court when she lived in Sweden, and a separate Chief Court Mistress as Queen of Norway at the Norwegian royal court, who served in her post during the visits of the Swedish-Norwegian royal family to Norway. Chief Court Mistress to Hedvig Elisabeth Charlotte of Holstein-Gottorp, 1814–1818 1817–1818: Karen Wedel-Jarlsberg Chief Court Mistress to Désirée Clary, 1823–1861 1825–1844: Karen Wedel-Jarlsberg Chief Court Mistress to Josephine of Leuchtenberg, 1844–1876 1844–1845: Karen Wedel-JarlsbergFanny Løvenskiold Chief Court Mistress to Louise of the Netherlands, 1859–1871 1859–1871: Juliane Cathrine Wilhelmine Wedel Jarlsberg Chief Court Mistress to Sophia of Nassau, 1872–1905 1873–1887: Alette Due1887–1905: Elise Løvenskiold Chief Court Mistress to Maud of Wales, 1905–1938 1906–1925: Marie Magdalena Rustad1925–1927: Emma Stang1927–1938: Borghild AnkerIn 1722, the Russian Imperial court was reorganized in accordance with the reforms of Peter the Great to Westernize Russia, and the old court offices of the Tsarina was replaced with court offices inspired by the German model. This was also the case when the office of hofmesterinde to the queen was left vacant in 1808–23 and 1839–45, and was handled by Friederiche Amalie Marie Hedevig von der Manfe and Marie Ernestine Wilhelmine von Walterstorf respectively. The incumbent is Kirstine von Blixen-Finecke, who has served from 2016. The first rank of the female courtiers was the Obersthofmeisterin, who was second in rank after the empress herself, and responsible for all the female courtiers. Hofmeisterin is an extremely weak basic (essentially neutral) compound (based on its pKa). Court Mistress (Danish: Hofmesterinde; Dutch: Hofmeesteres ('Court mistress'); German: Hofmeisterin; Norwegian: Hoffmesterinne; Swedish: Hovmästarinna) or Chief Court Mistress (Danish: Overhofmesterinde; Dutch: Grootmeesteres ('Grand Mistress') German: Obersthofmeisterin; Norwegian: Overhoffmesterinne; Swedish: öVerhovmästarinna; Russia: Ober-Hofmeisterin) is or was the title of the senior lady-in-waiting in the courts of Austria, Denmark, Norway, the Netherlands, Sweden, Imperial Russia, and the German princely and royal courts. Chief Court Mistress to Christina of Saxony, 1481–1513 1490–1496: Sidsel Lunge1503–1516: Anne Meinstrup Chief Court Mistress to Isabella of Austria, 1515–1523 1516–1517: Anne Meinstrup1517–1523: Sigbrit Willoms Chief Court Mistress to Sophie of Pomerania, 1523–1533 1526–1533: Anne Meinstrup Chief Court Mistress to Dorothea of Saxe-Lauenburg, 1534–1571 1557–1558: Fru Kirstine.1558– : Anne Albertsdatter Glob-Urne. Chief Court Mistress to Catherine I of Russia 1713–1725 Matryona BalkAgrippina Petrovna VolkonskaiaVarvara Michajlovna Arsen'eva Chief Court Mistress to Elizabeth of Russia 1741–1762 Chief Court Mistress to Catherine II of Russia 1762–1796 Chief Court Mistress to Maria Alexandrovna (Marie of Hesse and by Rhine) 1855–1880 1855–1863: Yekaterina Saltykov (in position since 1840) Chief Court Mistress to Maria Feodorovna (Dagmar of Denmark) 1881–1917 1881–1881: Princess Kurakin (in position since 1866)1881–1888: Princess Hélene Kotchoubey1888–: Countess Anna Stroganoff Chief Court Mistress to Alexandra Feodorovna (Alix of Hesse) 1894–1917 1894–1910: Maria Golitzyna1910–1917: Elizaveta NarishkinaIn Sweden, the Chief Court Mistress is the second highest-ranking official of the royal household, preceded only by the Marshal of the Realm. Chief court mistress to the queens of Prussia and empresses of Germany Chief Court Mistress to Sophia Louise of Mecklenburg-Schwerin 1708–1713 Chief Court Mistress to Sophia Dorothea of Hanover 1713–1757 Chief Court Mistress to Elisabeth Christine of Brunswick-Wolfenbüttel-Bevern 1740–1797 1740–1742: Christiane von Katsch (the same position with the crown princess since 1733)1742–1766: Sophie Caroline von Camas1766–1797: Charlotte Albertine von Kannenberg Chief Court Mistress to Frederika Louisa of Hesse-Darmstadt 1786–1805 Chief Court Mistress to Louise of Mecklenburg-Strelitz 1797–1810 1797–1810: Sophie Marie von Voß (the same position with the crown princess since 1793) Chief Court Mistress to Elisabeth Ludovika of Bavaria 1840–1873 Wilhelmine van Reede-Ginkel Chief Court Mistress to Augusta of Saxe-Weimar-Eisenach 1861–1891 Chief Court Mistress to Augusta Victoria of Schleswig-Holstein 1888–1918 The Netherlands In the 16th-century, the principal lady-in-waiting in the courts of the Habsburg governors of the Netherlands, Margaret of Austria and Mary of Hungary (governor of the Netherlands), was named hofmesterees ('Court mistress') or dame d'honneur. Chief Court Mistress to Anna of Tyrol, 1608–1618 1611–1618: Freiin Katharina v. Kollowrath-L. She also managed the ceremony of the court presentation, in which nobles were presented to the royal family and thus allowed to show themselves officially at court. Hofmeisterin is found in Hofmeisteria schaffneri. The title and position have changed over time.

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1533004241505052D          

 15 15  0  0  0  0            999 V2000
    0.0000   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -3.7125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013   -3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158   -4.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868   -4.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -4.1250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  2  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  6  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
 13 14  2  0  0  0  0
  8 14  1  0  0  0  0
 14 15  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0078496

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CC(=O)OCC(=O)C1=CC=C(C)C=C1O

> <INCHI_IDENTIFIER>
InChI=1S/C11H12O4/c1-7-3-4-9(10(13)5-7)11(14)6-15-8(2)12/h3-5,13H,6H2,1-2H3

> <INCHI_KEY>
LHLJANTYAXQUPZ-UHFFFAOYSA-N

> <FORMULA>
C11H12O4

> <MOLECULAR_WEIGHT>
208.213

> <EXACT_MASS>
208.073558866

> <JCHEM_ACCEPTOR_COUNT>
3

> <JCHEM_ATOM_COUNT>
27

> <JCHEM_AVERAGE_POLARIZABILITY>
21.5018566459459

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
2-(2-hydroxy-4-methylphenyl)-2-oxoethyl acetate

> <ALOGPS_LOGP>
1.76

> <JCHEM_LOGP>
2.014626766666667

> <ALOGPS_LOGS>
-2.47

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
14.229033273002951

> <JCHEM_PKA_STRONGEST_ACIDIC>
9.12880596111515

> <JCHEM_PKA_STRONGEST_BASIC>
-5.211092498009553

> <JCHEM_POLAR_SURFACE_AREA>
63.60000000000001

> <JCHEM_REFRACTIVITY>
54.33660000000001

> <JCHEM_ROTATABLE_BOND_COUNT>
4

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
7.12e-01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
2-(2-hydroxy-4-methylphenyl)-2-oxoethyl acetate

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 24-APR-15   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-APR-15         0                                  
HETATM    1  C   UNK     0       0.000  -4.620   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       1.334  -5.390   0.000  0.00  0.00           C+0
HETATM    3  O   UNK     0       1.334  -6.930   0.000  0.00  0.00           O+0
HETATM    4  O   UNK     0       2.667  -4.620   0.000  0.00  0.00           O+0
HETATM    5  C   UNK     0       4.001  -5.390   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       5.335  -4.620   0.000  0.00  0.00           C+0
HETATM    7  O   UNK     0       5.335  -3.080   0.000  0.00  0.00           O+0
HETATM    8  C   UNK     0       6.668  -5.390   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       8.002  -4.620   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       9.336  -5.390   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       9.336  -6.930   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      10.669  -7.700   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       8.002  -7.700   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       6.668  -6.930   0.000  0.00  0.00           C+0
HETATM   15  O   UNK     0       5.335  -7.700   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3    4                                                  
CONECT    3    2                                                            
CONECT    4    2    5                                                       
CONECT    5    4    6                                                       
CONECT    6    5    7    8                                                  
CONECT    7    6                                                            
CONECT    8    6    9   14                                                  
CONECT    9    8   10                                                       
CONECT   10    9   11                                                       
CONECT   11   10   12   13                                                  
CONECT   12   11                                                            
CONECT   13   11   14                                                       
CONECT   14   13    8   15                                                  
CONECT   15   14                                                            
MASTER        0    0    0    0    0    0    0    0   15    0   30    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₁₁H₁₂O₄

Average Mass

208.2130 Da

Monoisotopic Mass

208.07356 Da

IUPAC Name

2-(2-hydroxy-4-methylphenyl)-2-oxoethyl acetate

Traditional Name

2-(2-hydroxy-4-methylphenyl)-2-oxoethyl acetate

CAS Registry Number

Not Available

SMILES

CC(=O)OCC(=O)C1=CC=C(C)C=C1O

InChI Identifier

InChI=1S/C11H12O4/c1-7-3-4-9(10(13)5-7)11(14)6-15-8(2)12/h3-5,13H,6H2,1-2H3

InChI Key

LHLJANTYAXQUPZ-UHFFFAOYSA-N

Experimental Spectra

Not Available

Predicted Spectra

Spectrum Type	Description	Depositor ID	Depositor Organization	Depositor	Deposition Date	View
1D NMR	¹³C NMR Spectrum (1D, 25 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 252 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 50 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 75 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 101 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 126 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 151 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 176 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 201 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 226 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum

Chemical Shift Submissions

Not Available

Species

Species of Origin

Species Name	Source	Reference
Hofmeisteria schaffneri	Plant	KNApSAcK

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.

Kingdom

Organic compounds

Super Class

Organic oxygen compounds

Class

Organooxygen compounds

Sub Class

Carbonyl compounds

Direct Parent

Alkyl-phenylketones

Alternative Parents

Substituents

Alkyl-phenylketone
Benzoyl
Aryl alkyl ketone
M-cresol
1-hydroxy-4-unsubstituted benzenoid
1-hydroxy-2-unsubstituted benzenoid
Alpha-acyloxy ketone
Toluene
Phenol
Monocyclic benzene moiety
Benzenoid
Vinylogous acid
Carboxylic acid ester
Carboxylic acid derivative
Monocarboxylic acid or derivatives
Hydrocarbon derivative
Organic oxide
Aromatic homomonocyclic compound

Molecular Framework

Aromatic homomonocyclic compounds

External Descriptors

Not Available

Physical Properties

State

Not Available

Experimental Properties

Property	Value	Reference
Melting Point	Not Available	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	Not Available	Not Available
LogP	Not Available	Not Available

Predicted Properties

Property	Value	Source
logP	1.76	ALOGPS
logP	2.01	ChemAxon
logS	-2.5	ALOGPS
pKa (Strongest Acidic)	9.13	ChemAxon
pKa (Strongest Basic)	-5.2	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	3	ChemAxon
Hydrogen Donor Count	1	ChemAxon
Polar Surface Area	63.6 Å²	ChemAxon
Rotatable Bond Count	4	ChemAxon
Refractivity	54.34 m³·mol⁻¹	ChemAxon
Polarizability	21.5 Å³	ChemAxon
Number of Rings	1	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	Yes	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

External Links

HMDB ID

Not Available

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

Not Available

KNApSAcK ID

Not Available

Chemspider ID

Not Available

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Chief Court Mistress

METLIN ID

Not Available

PubChem Compound

11148458

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Not Available

Showing NP-Card for Hofmeisterin (NP0078496)

MOL for NP0078496 (Hofmeisterin)

3D MOL for NP0078496 (Hofmeisterin)

3D SDF for NP0078496 (Hofmeisterin)

3D-SDF for NP0078496 (Hofmeisterin)

PDB for NP0078496 (Hofmeisterin)

3D PDB for NP0078496 (Hofmeisterin)

SMILES for NP0078496 (Hofmeisterin)

INCHI for NP0078496 (Hofmeisterin)

Structure for NP0078496 (Hofmeisterin)

3D Structure for NP0078496 (Hofmeisterin)