NP-MRD: Showing NP-Card for 4-methoxy-6-[(1r,2r,3s,4s)-3-(4-methoxy-6-oxopyran-2-yl)-2,4-bis(4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)cyclobutyl]pyran-2-one (NP0303757)

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Record Information

Version

2.0

Created at

2022-09-10 18:22:53 UTC

Updated at

2022-09-10 18:22:53 UTC

NP-MRD ID

NP0303757

Secondary Accession Numbers

None

Natural Product Identification

Common Name

4-methoxy-6-[(1r,2r,3s,4s)-3-(4-methoxy-6-oxopyran-2-yl)-2,4-bis(4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)cyclobutyl]pyran-2-one

Description

Not Available

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1652309102220222D          

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M  END

     RDKit          3D

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 28 79  1  0
M  END


  Mrv1652309102220222D          

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    3.3631   -5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4317   -3.8937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.1942   -3.1792    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2183   -2.4647    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.0433   -2.4647    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4558   -1.7502    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.2808   -1.7502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6933   -2.4647    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0433   -1.0358    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.4558   -0.3213    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2183   -1.0358    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
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    1.0192   -1.7502    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4317   -2.4647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2567   -2.4647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3631   -1.3583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  9  8  1  1  0  0  0
  9 10  1  0  0  0  0
 10 11  1  6  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 16 15  1  6  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  6  0  0  0
 19 20  1  0  0  0  0
 18 21  1  0  0  0  0
 21 22  1  1  0  0  0
 21 23  1  0  0  0  0
 23 24  1  6  0  0  0
 23 25  1  0  0  0  0
 16 25  1  0  0  0  0
 25 26  1  1  0  0  0
 14 27  1  0  0  0  0
 27 28  2  0  0  0  0
 11 28  1  0  0  0  0
 10 29  1  0  0  0  0
 29 30  1  6  0  0  0
 30 31  2  0  0  0  0
 31 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 32 35  2  0  0  0  0
 35 36  1  0  0  0  0
 36 37  2  0  0  0  0
 36 38  1  0  0  0  0
 30 38  1  0  0  0  0
 29 39  1  0  0  0  0
  9 39  1  0  0  0  0
 39 40  1  1  0  0  0
 40 41  2  0  0  0  0
 41 42  1  0  0  0  0
 42 43  2  0  0  0  0
 43 44  1  0  0  0  0
 45 44  1  6  0  0  0
 45 46  1  0  0  0  0
 46 47  1  0  0  0  0
 47 48  1  6  0  0  0
 48 49  1  0  0  0  0
 47 50  1  0  0  0  0
 50 51  1  1  0  0  0
 50 52  1  0  0  0  0
 52 53  1  6  0  0  0
 52 54  1  0  0  0  0
 45 54  1  0  0  0  0
 54 55  1  1  0  0  0
 43 56  1  0  0  0  0
 56 57  2  0  0  0  0
 40 57  1  0  0  0  0
  8 58  2  0  0  0  0
  3 58  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0303757

> <DATABASE_NAME>
NP-MRD

> <SMILES>
COC1=CC(=O)OC(=C1)[C@H]1[C@@H]([C@@H]([C@H]1C1=CC=C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C=C1)C1=CC(OC)=CC(=O)O1)C1=CC=C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C=C1

> <INCHI_IDENTIFIER>
InChI=1S/C40H44O18/c1-51-21-11-23(55-27(43)13-21)31-29(17-3-7-19(8-4-17)53-39-37(49)35(47)33(45)25(15-41)57-39)32(24-12-22(52-2)14-28(44)56-24)30(31)18-5-9-20(10-6-18)54-40-38(50)36(48)34(46)26(16-42)58-40/h3-14,25-26,29-42,45-50H,15-16H2,1-2H3/t25-,26-,29-,30-,31-,32-,33-,34-,35+,36+,37-,38-,39-,40-/m1/s1

> <INCHI_KEY>
GDLOSEKDTGZMKZ-YLRYDLBXSA-N

> <FORMULA>
C40H44O18

> <MOLECULAR_WEIGHT>
812.774

> <EXACT_MASS>
812.252764577

> <JCHEM_ACCEPTOR_COUNT>
16

> <JCHEM_ATOM_COUNT>
102

> <JCHEM_AVERAGE_POLARIZABILITY>
81.38017826845544

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
8

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
4-methoxy-6-[(1R,2R,3S,4S)-3-(4-methoxy-2-oxo-2H-pyran-6-yl)-2,4-bis(4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)cyclobutyl]-2H-pyran-2-one

> <JCHEM_LOGP>
-1.0194013066666663

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
7

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA>
12.42131284228655

> <JCHEM_PKA_STRONGEST_ACIDIC>
11.899111779164967

> <JCHEM_PKA_STRONGEST_BASIC>
-2.981092343686494

> <JCHEM_POLAR_SURFACE_AREA>
269.81999999999994

> <JCHEM_REFRACTIVITY>
199.83880000000005

> <JCHEM_ROTATABLE_BOND_COUNT>
12

> <JCHEM_RULE_OF_FIVE>
0

> <JCHEM_TRADITIONAL_IUPAC>
4-methoxy-6-[(1R,2R,3S,4S)-3-(4-methoxy-6-oxopyran-2-yl)-2,4-bis(4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)cyclobutyl]pyran-2-one

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 10-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   10-SEP-22         0                                  
HETATM    1  C   UNK     0       3.610  -0.996   0.000  0.00  0.00           C+0
HETATM    2  O   UNK     0       4.944  -0.226   0.000  0.00  0.00           O+0
HETATM    3  C   UNK     0       6.278  -0.996   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       7.611  -0.226   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       8.945  -0.996   0.000  0.00  0.00           C+0
HETATM    6  O   UNK     0      10.279  -0.226   0.000  0.00  0.00           O+0
HETATM    7  O   UNK     0       8.945  -2.536   0.000  0.00  0.00           O+0
HETATM    8  C   UNK     0       7.611  -3.306   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       7.611  -4.846   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       8.700  -5.934   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      10.240  -5.934   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      11.010  -4.601   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      12.550  -4.601   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      13.320  -5.934   0.000  0.00  0.00           C+0
HETATM   15  O   UNK     0      14.860  -5.934   0.000  0.00  0.00           O+0
HETATM   16  C   UNK     0      15.630  -7.268   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0      17.170  -7.268   0.000  0.00  0.00           O+0
HETATM   18  C   UNK     0      17.940  -8.602   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      19.480  -8.602   0.000  0.00  0.00           C+0
HETATM   20  O   UNK     0      20.250  -9.936   0.000  0.00  0.00           O+0
HETATM   21  C   UNK     0      17.170  -9.936   0.000  0.00  0.00           C+0
HETATM   22  O   UNK     0      17.940 -11.269   0.000  0.00  0.00           O+0
HETATM   23  C   UNK     0      15.630  -9.936   0.000  0.00  0.00           C+0
HETATM   24  O   UNK     0      14.860 -11.269   0.000  0.00  0.00           O+0
HETATM   25  C   UNK     0      14.860  -8.602   0.000  0.00  0.00           C+0
HETATM   26  O   UNK     0      13.320  -8.602   0.000  0.00  0.00           O+0
HETATM   27  C   UNK     0      12.550  -7.268   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0      11.010  -7.268   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0       7.611  -7.023   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0       7.611  -8.563   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0       8.945  -9.333   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0       8.945 -10.873   0.000  0.00  0.00           C+0
HETATM   33  O   UNK     0      10.279 -11.643   0.000  0.00  0.00           O+0
HETATM   34  C   UNK     0      10.279 -13.183   0.000  0.00  0.00           C+0
HETATM   35  C   UNK     0       7.611 -11.643   0.000  0.00  0.00           C+0
HETATM   36  C   UNK     0       6.278 -10.873   0.000  0.00  0.00           C+0
HETATM   37  O   UNK     0       4.944 -11.643   0.000  0.00  0.00           O+0
HETATM   38  O   UNK     0       6.278  -9.333   0.000  0.00  0.00           O+0
HETATM   39  C   UNK     0       6.523  -5.934   0.000  0.00  0.00           C+0
HETATM   40  C   UNK     0       4.983  -5.934   0.000  0.00  0.00           C+0
HETATM   41  C   UNK     0       4.213  -7.268   0.000  0.00  0.00           C+0
HETATM   42  C   UNK     0       2.673  -7.268   0.000  0.00  0.00           C+0
HETATM   43  C   UNK     0       1.903  -5.934   0.000  0.00  0.00           C+0
HETATM   44  O   UNK     0       0.363  -5.934   0.000  0.00  0.00           O+0
HETATM   45  C   UNK     0      -0.407  -4.601   0.000  0.00  0.00           C+0
HETATM   46  O   UNK     0      -1.947  -4.601   0.000  0.00  0.00           O+0
HETATM   47  C   UNK     0      -2.717  -3.267   0.000  0.00  0.00           C+0
HETATM   48  C   UNK     0      -4.257  -3.267   0.000  0.00  0.00           C+0
HETATM   49  O   UNK     0      -5.027  -4.601   0.000  0.00  0.00           O+0
HETATM   50  C   UNK     0      -1.947  -1.933   0.000  0.00  0.00           C+0
HETATM   51  O   UNK     0      -2.717  -0.600   0.000  0.00  0.00           O+0
HETATM   52  C   UNK     0      -0.407  -1.933   0.000  0.00  0.00           C+0
HETATM   53  O   UNK     0       0.363  -0.600   0.000  0.00  0.00           O+0
HETATM   54  C   UNK     0       0.363  -3.267   0.000  0.00  0.00           C+0
HETATM   55  O   UNK     0       1.903  -3.267   0.000  0.00  0.00           O+0
HETATM   56  C   UNK     0       2.673  -4.601   0.000  0.00  0.00           C+0
HETATM   57  C   UNK     0       4.213  -4.601   0.000  0.00  0.00           C+0
HETATM   58  C   UNK     0       6.278  -2.536   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3                                                       
CONECT    3    2    4   58                                                  
CONECT    4    3    5                                                       
CONECT    5    4    6    7                                                  
CONECT    6    5                                                            
CONECT    7    5    8                                                       
CONECT    8    7    9   58                                                  
CONECT    9    8   10   39                                                  
CONECT   10    9   11   29                                                  
CONECT   11   10   12   28                                                  
CONECT   12   11   13                                                       
CONECT   13   12   14                                                       
CONECT   14   13   15   27                                                  
CONECT   15   14   16                                                       
CONECT   16   15   17   25                                                  
CONECT   17   16   18                                                       
CONECT   18   17   19   21                                                  
CONECT   19   18   20                                                       
CONECT   20   19                                                            
CONECT   21   18   22   23                                                  
CONECT   22   21                                                            
CONECT   23   21   24   25                                                  
CONECT   24   23                                                            
CONECT   25   23   16   26                                                  
CONECT   26   25                                                            
CONECT   27   14   28                                                       
CONECT   28   27   11                                                       
CONECT   29   10   30   39                                                  
CONECT   30   29   31   38                                                  
CONECT   31   30   32                                                       
CONECT   32   31   33   35                                                  
CONECT   33   32   34                                                       
CONECT   34   33                                                            
CONECT   35   32   36                                                       
CONECT   36   35   37   38                                                  
CONECT   37   36                                                            
CONECT   38   36   30                                                       
CONECT   39   29    9   40                                                  
CONECT   40   39   41   57                                                  
CONECT   41   40   42                                                       
CONECT   42   41   43                                                       
CONECT   43   42   44   56                                                  
CONECT   44   43   45                                                       
CONECT   45   44   46   54                                                  
CONECT   46   45   47                                                       
CONECT   47   46   48   50                                                  
CONECT   48   47   49                                                       
CONECT   49   48                                                            
CONECT   50   47   51   52                                                  
CONECT   51   50                                                            
CONECT   52   50   53   54                                                  
CONECT   53   52                                                            
CONECT   54   52   45   55                                                  
CONECT   55   54                                                            
CONECT   56   43   57                                                       
CONECT   57   56   40                                                       
CONECT   58    8    3                                                       
MASTER        0    0    0    0    0    0    0    0   58    0  128    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₄₀H₄₄O₁₈

Average Mass

812.7740 Da

Monoisotopic Mass

812.25276 Da

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

COC1=CC(=O)OC(=C1)[C@H]1[C@@H]([C@@H]([C@H]1C1=CC=C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C=C1)C1=CC(OC)=CC(=O)O1)C1=CC=C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C=C1

InChI Identifier

InChI=1S/C40H44O18/c1-51-21-11-23(55-27(43)13-21)31-29(17-3-7-19(8-4-17)53-39-37(49)35(47)33(45)25(15-41)57-39)32(24-12-22(52-2)14-28(44)56-24)30(31)18-5-9-20(10-6-18)54-40-38(50)36(48)34(46)26(16-42)58-40/h3-14,25-26,29-42,45-50H,15-16H2,1-2H3/t25-,26-,29-,30-,31-,32-,33-,34-,35+,36+,37-,38-,39-,40-/m1/s1

InChI Key

GDLOSEKDTGZMKZ-YLRYDLBXSA-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, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 100 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 252 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 1000 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 50 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 200 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 75 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 300 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 101 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 400 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 126 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 500 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 151 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 600 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 176 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 700 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 201 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 800 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 226 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 900 MHz, H₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum

Chemical Shift Submissions

Not Available

Species

Species of Origin

Not Available

Chemical Taxonomy

Classification

Not classified

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

External Links

Not Available

References

General References

LOTUS database [Link]

Showing NP-Card for 4-methoxy-6-[(1r,2r,3s,4s)-3-(4-methoxy-6-oxopyran-2-yl)-2,4-bis(4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)cyclobutyl]pyran-2-one (NP0303757)

MOL for NP0303757 (4-methoxy-6-[(1r,2r,3s,4s)-3-(4-methoxy-6-oxopyran-2-yl)-2,4-bis(4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)cyclobutyl]pyran-2-one)

3D MOL for NP0303757 (4-methoxy-6-[(1r,2r,3s,4s)-3-(4-methoxy-6-oxopyran-2-yl)-2,4-bis(4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)cyclobutyl]pyran-2-one)

3D SDF for NP0303757 (4-methoxy-6-[(1r,2r,3s,4s)-3-(4-methoxy-6-oxopyran-2-yl)-2,4-bis(4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)cyclobutyl]pyran-2-one)

3D-SDF for NP0303757 (4-methoxy-6-[(1r,2r,3s,4s)-3-(4-methoxy-6-oxopyran-2-yl)-2,4-bis(4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)cyclobutyl]pyran-2-one)

PDB for NP0303757 (4-methoxy-6-[(1r,2r,3s,4s)-3-(4-methoxy-6-oxopyran-2-yl)-2,4-bis(4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)cyclobutyl]pyran-2-one)

3D PDB for NP0303757 (4-methoxy-6-[(1r,2r,3s,4s)-3-(4-methoxy-6-oxopyran-2-yl)-2,4-bis(4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)cyclobutyl]pyran-2-one)

SMILES for NP0303757 (4-methoxy-6-[(1r,2r,3s,4s)-3-(4-methoxy-6-oxopyran-2-yl)-2,4-bis(4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)cyclobutyl]pyran-2-one)

INCHI for NP0303757 (4-methoxy-6-[(1r,2r,3s,4s)-3-(4-methoxy-6-oxopyran-2-yl)-2,4-bis(4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)cyclobutyl]pyran-2-one)

Structure for NP0303757 (4-methoxy-6-[(1r,2r,3s,4s)-3-(4-methoxy-6-oxopyran-2-yl)-2,4-bis(4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)cyclobutyl]pyran-2-one)

3D Structure for NP0303757 (4-methoxy-6-[(1r,2r,3s,4s)-3-(4-methoxy-6-oxopyran-2-yl)-2,4-bis(4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)cyclobutyl]pyran-2-one)