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Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
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17-acetyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthren-3-one (C21H28O2)

Natural Isotopic formula weight: 312.44582

View large 3D structure

bmse001135 Data

Entry STAR file: bmse001135.str
NMR-STAR interactive viewer
Mol file: bmse001135.mol
All files for bmse001135
Time Domain Data: bmse001135.zip
BMRB Entry DOI: doi:10.13018/BMSE001135

solute:   100 mM 17-acetyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthren-3-one
solvent:   100.0 % Chloroform-d
reference:   0.05 % TMS

Concentration and pH are given with spectrum
Spectrometer: Bruker Avance III - 500 MHz

Data Source: National Magnetic Resonance Facility at Madison - Maria . Nesterova ., Lawrence J. Clos II, Christopher . Stancic ., Mark E. Anderson ., John L. Markley ..

Experimental Data:

1D 1H

Concentration: 100 mM
temperature: 298 K
pH: Unknown
1D 1H, Unknown spectrum for 17-acetyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthren-3-one
Download data directory: bmse001135_1.zip

2D 1H-1H TOCSY

Concentration: 100 mM
temperature: 298 K
pH: Unknown
2D 1H-1H TOCSY, Unknown spectrum for 17-acetyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthren-3-one
Download data directory: bmse001135_2.zip

1D 13C

Concentration: 100 mM
temperature: 298 K
pH: Unknown
1D 13C, Unknown spectrum for 17-acetyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthren-3-one
Download data directory: bmse001135_3.zip

1D DEPT90

Concentration: 100 mM
temperature: 298 K
pH: Unknown
1D DEPT90, Unknown spectrum for 17-acetyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthren-3-one
Download data directory: bmse001135_4.zip

1D DEPT135

Concentration: 100 mM
temperature: 298 K
pH: Unknown
1D DEPT135, Unknown spectrum for 17-acetyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthren-3-one
Download data directory: bmse001135_5.zip

2D 1H-13C HSQC

Concentration: 100 mM
temperature: 298 K
pH: Unknown
2D 1H-13C HSQC, Unknown spectrum for 17-acetyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthren-3-one
Download data directory: bmse001135_6.zip

2D 1H-13C HSQC SW small

Concentration: 100 mM
temperature: 298 K
pH: Unknown
Download data directory: bmse001135_7.zip

2D 1H-13C HMBC

Concentration: 100 mM
temperature: 298 K
pH: Unknown
2D 1H-13C HMBC, Unknown spectrum for 17-acetyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthren-3-one
Download data directory: bmse001135_8.zip

2D 1H-1H COSY

Concentration: 100 mM
temperature: 298 K
pH: Unknown
2D 1H-1H COSY, Unknown spectrum for 17-acetyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthren-3-one
Download data directory: bmse001135_9.zip

2D 1H-13C HSQC-TOCSY-ADIA

Concentration: 100 mM
temperature: 298 K
pH: Unknown
2D 1H-13C HSQC-TOCSY-ADIA, Unknown spectrum for 17-acetyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthren-3-one
Download data directory: bmse001135_10.zip