NP-MRD: Showing NP-Card for (2r,4r,6r)-6-[(2r)-2-(2-{2-[(3e,6e,8s,9e)-6,8-dimethylundeca-3,6,9-trien-1-yl]-1,3-oxazol-4-yl}-1,3-oxazol-4-yl)-2-methoxyethyl]-2-methoxy-2-methyloxan-4-ol (NP0236707)

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Record Information

Version

2.0

Created at

2022-09-06 19:40:32 UTC

Updated at

2022-09-06 19:40:32 UTC

NP-MRD ID

NP0236707

Secondary Accession Numbers

None

Natural Product Identification

Common Name

(2r,4r,6r)-6-[(2r)-2-(2-{2-[(3e,6e,8s,9e)-6,8-dimethylundeca-3,6,9-trien-1-yl]-1,3-oxazol-4-yl}-1,3-oxazol-4-yl)-2-methoxyethyl]-2-methoxy-2-methyloxan-4-ol

Description

Hennoxazole A belongs to the class of organic compounds known as 2,4-disubstituted oxazoles. 2,4-Disubstituted oxazoles are compounds containing an oxazole ring substituted at positions 2 and 4 only. Oxazole is a five-membered aromatic heterocycle with one oxygen, one nitrogen, and three carbon atoms. Isomers include 1,2-oxazole and 1,3-oxazole. (2r,4r,6r)-6-[(2r)-2-(2-{2-[(3e,6e,8s,9e)-6,8-dimethylundeca-3,6,9-trien-1-yl]-1,3-oxazol-4-yl}-1,3-oxazol-4-yl)-2-methoxyethyl]-2-methoxy-2-methyloxan-4-ol was first documented in 2007 (PMID: 17316014). Based on a literature review very few articles have been published on Hennoxazole A (PMID: 18052386).

Structure

MOL SDF PDB SMILES InChI


  Mrv1652309062221402D          

 37 39  0  0  1  0            999 V2000
    2.2624   -2.2155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5480   -1.8030    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5480   -0.9780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8335   -0.5655    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.8335    0.2595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1190   -0.9780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5955   -0.5655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5955    0.2595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3099   -0.9780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3099   -1.8030    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0244   -2.2155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0244   -3.0405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3099   -3.4530    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3099   -4.2780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6425   -4.7629    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8974   -5.5475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4125   -6.2149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4125   -6.2149    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6674   -6.9996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4521   -7.2545    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.6236   -8.0615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4082   -8.3164    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.0213   -7.7644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8059   -8.0193    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.4190   -7.4673    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9775   -8.8263    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3644   -9.3783    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.0145   -9.8862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9770  -10.1068    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4142  -10.8064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5797   -9.1234    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0652   -6.7025    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8498   -6.9574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -7.4845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6674   -6.9996    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7224   -5.5475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9774   -4.7629    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
  3  4  1  0  0  0  0
  4  5  1  1  0  0  0
  4  6  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  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
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 22 21  1  1  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  1  0  0  0
 24 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  1  0  0  0
 27 29  1  6  0  0  0
 29 30  1  0  0  0  0
 27 31  1  0  0  0  0
 22 31  1  0  0  0  0
 20 32  1  6  0  0  0
 32 33  1  0  0  0  0
 19 34  2  0  0  0  0
 34 35  1  0  0  0  0
 17 35  1  0  0  0  0
 16 36  2  0  0  0  0
 36 37  1  0  0  0  0
 14 37  1  0  0  0  0
M  END


  Mrv1652309062221402D          

 37 39  0  0  1  0            999 V2000
    2.2624   -2.2155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5480   -1.8030    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5480   -0.9780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8335   -0.5655    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.8335    0.2595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1190   -0.9780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5955   -0.5655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5955    0.2595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3099   -0.9780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3099   -1.8030    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0244   -2.2155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0244   -3.0405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3099   -3.4530    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3099   -4.2780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6425   -4.7629    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8974   -5.5475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4125   -6.2149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4125   -6.2149    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6674   -6.9996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4521   -7.2545    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.6236   -8.0615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4082   -8.3164    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.0213   -7.7644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8059   -8.0193    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.4190   -7.4673    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9775   -8.8263    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3644   -9.3783    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.0145   -9.8862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9770  -10.1068    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4142  -10.8064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5797   -9.1234    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0652   -6.7025    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8498   -6.9574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -7.4845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6674   -6.9996    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7224   -5.5475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9774   -4.7629    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
  3  4  1  0  0  0  0
  4  5  1  1  0  0  0
  4  6  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  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
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 22 21  1  1  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  1  0  0  0
 24 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  1  0  0  0
 27 29  1  6  0  0  0
 29 30  1  0  0  0  0
 27 31  1  0  0  0  0
 22 31  1  0  0  0  0
 20 32  1  6  0  0  0
 32 33  1  0  0  0  0
 19 34  2  0  0  0  0
 34 35  1  0  0  0  0
 17 35  1  0  0  0  0
 16 36  2  0  0  0  0
 36 37  1  0  0  0  0
 14 37  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0236707

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CO[C@H](C[C@H]1C[C@@H](O)C[C@](C)(OC)O1)C1=COC(=N1)C1=COC(CC\C=C\C\C(C)=C\[C@@H](C)\C=C\C)=N1

> <INCHI_IDENTIFIER>
InChI=1S/C29H42N2O6/c1-7-11-20(2)14-21(3)12-9-8-10-13-27-30-25(19-35-27)28-31-24(18-36-28)26(33-5)16-23-15-22(32)17-29(4,34-6)37-23/h7-9,11,14,18-20,22-23,26,32H,10,12-13,15-17H2,1-6H3/b9-8+,11-7+,21-14+/t20-,22+,23+,26+,29+/m0/s1

> <INCHI_KEY>
VWYQNGGNAXAFAX-FAPKGILYSA-N

> <FORMULA>
C29H42N2O6

> <MOLECULAR_WEIGHT>
514.663

> <EXACT_MASS>
514.30428708

> <JCHEM_ACCEPTOR_COUNT>
6

> <JCHEM_ATOM_COUNT>
79

> <JCHEM_AVERAGE_POLARIZABILITY>
59.94375464107051

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(2R,4R,6R)-6-[(2R)-2-(2-{2-[(3E,6E,8S,9E)-6,8-dimethylundeca-3,6,9-trien-1-yl]-1,3-oxazol-4-yl}-1,3-oxazol-4-yl)-2-methoxyethyl]-2-methoxy-2-methyloxan-4-ol

> <JCHEM_LOGP>
4.834307598333332

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_ACIDIC>
15.00300641607387

> <JCHEM_PKA_STRONGEST_BASIC>
-0.8592166357931682

> <JCHEM_POLAR_SURFACE_AREA>
99.98000000000002

> <JCHEM_REFRACTIVITY>
155.34629999999996

> <JCHEM_ROTATABLE_BOND_COUNT>
13

> <JCHEM_RULE_OF_FIVE>
0

> <JCHEM_TRADITIONAL_IUPAC>
(2R,4R,6R)-6-[(2R)-2-(2-{2-[(3E,6E,8S,9E)-6,8-dimethylundeca-3,6,9-trien-1-yl]-1,3-oxazol-4-yl}-1,3-oxazol-4-yl)-2-methoxyethyl]-2-methoxy-2-methyloxan-4-ol

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 06-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   06-SEP-22         0                                  
HETATM    1  C   UNK     0       4.223  -4.136   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       2.890  -3.366   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       2.890  -1.826   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       1.556  -1.056   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       1.556   0.484   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       0.222  -1.826   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      -1.112  -1.056   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -1.112   0.484   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      -2.445  -1.826   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      -2.445  -3.366   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -3.779  -4.136   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      -3.779  -5.676   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      -2.445  -6.446   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      -2.445  -7.986   0.000  0.00  0.00           C+0
HETATM   15  N   UNK     0      -1.199  -8.891   0.000  0.00  0.00           N+0
HETATM   16  C   UNK     0      -1.675 -10.355   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      -0.770 -11.601   0.000  0.00  0.00           C+0
HETATM   18  N   UNK     0       0.770 -11.601   0.000  0.00  0.00           N+0
HETATM   19  C   UNK     0       1.246 -13.066   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       2.711 -13.542   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       3.031 -15.048   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       4.495 -15.524   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0       5.640 -14.494   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0       7.104 -14.969   0.000  0.00  0.00           C+0
HETATM   25  O   UNK     0       8.249 -13.939   0.000  0.00  0.00           O+0
HETATM   26  C   UNK     0       7.425 -16.476   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0       6.280 -17.506   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0       7.494 -18.454   0.000  0.00  0.00           C+0
HETATM   29  O   UNK     0       5.557 -18.866   0.000  0.00  0.00           O+0
HETATM   30  C   UNK     0       6.373 -20.172   0.000  0.00  0.00           C+0
HETATM   31  O   UNK     0       4.816 -17.030   0.000  0.00  0.00           O+0
HETATM   32  O   UNK     0       3.855 -12.511   0.000  0.00  0.00           O+0
HETATM   33  C   UNK     0       5.320 -12.987   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0       0.000 -13.971   0.000  0.00  0.00           C+0
HETATM   35  O   UNK     0      -1.246 -13.066   0.000  0.00  0.00           O+0
HETATM   36  C   UNK     0      -3.215 -10.355   0.000  0.00  0.00           C+0
HETATM   37  O   UNK     0      -3.691  -8.891   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3                                                       
CONECT    3    2    4                                                       
CONECT    4    3    5    6                                                  
CONECT    5    4                                                            
CONECT    6    4    7                                                       
CONECT    7    6    8    9                                                  
CONECT    8    7                                                            
CONECT    9    7   10                                                       
CONECT   10    9   11                                                       
CONECT   11   10   12                                                       
CONECT   12   11   13                                                       
CONECT   13   12   14                                                       
CONECT   14   13   15   37                                                  
CONECT   15   14   16                                                       
CONECT   16   15   17   36                                                  
CONECT   17   16   18   35                                                  
CONECT   18   17   19                                                       
CONECT   19   18   20   34                                                  
CONECT   20   19   21   32                                                  
CONECT   21   20   22                                                       
CONECT   22   21   23   31                                                  
CONECT   23   22   24                                                       
CONECT   24   23   25   26                                                  
CONECT   25   24                                                            
CONECT   26   24   27                                                       
CONECT   27   26   28   29   31                                             
CONECT   28   27                                                            
CONECT   29   27   30                                                       
CONECT   30   29                                                            
CONECT   31   27   22                                                       
CONECT   32   20   33                                                       
CONECT   33   32                                                            
CONECT   34   19   35                                                       
CONECT   35   34   17                                                       
CONECT   36   16   37                                                       
CONECT   37   36   14                                                       
MASTER        0    0    0    0    0    0    0    0   37    0   78    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₂₉H₄₂N₂O₆

Average Mass

514.6630 Da

Monoisotopic Mass

514.30429 Da

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

CO[C@H](C[C@H]1C[C@@H](O)C[C@](C)(OC)O1)C1=COC(=N1)C1=COC(CC\C=C\C\C(C)=C\[C@@H](C)\C=C\C)=N1

InChI Identifier

InChI=1S/C29H42N2O6/c1-7-11-20(2)14-21(3)12-9-8-10-13-27-30-25(19-35-27)28-31-24(18-36-28)26(33-5)16-23-15-22(32)17-29(4,34-6)37-23/h7-9,11,14,18-20,22-23,26,32H,10,12-13,15-17H2,1-6H3/b9-8+,11-7+,21-14+/t20-,22+,23+,26+,29+/m0/s1

InChI Key

VWYQNGGNAXAFAX-FAPKGILYSA-N

Experimental Spectra

Not Available

Predicted Spectra

Not Available

Chemical Shift Submissions

Not Available

Species

Species of Origin

Not Available

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as 2,4-disubstituted oxazoles. 2,4-Disubstituted oxazoles are compounds containing an oxazole ring substituted at positions 2 and 4 only. Oxazole is a five-membered aromatic heterocycle with one oxygen, one nitrogen, and three carbon atoms. Isomers include 1,2-oxazole and 1,3-oxazole.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Azoles

Sub Class

Oxazoles

Direct Parent

2,4-disubstituted oxazoles

Alternative Parents

Substituents

2,4-disubstituted 1,3-oxazole
Ketal
Oxane
Heteroaromatic compound
Secondary alcohol
Acetal
Dialkyl ether
Ether
Azacycle
Oxacycle
Organooxygen compound
Organonitrogen compound
Alcohol
Organic oxygen compound
Organopnictogen compound
Organic nitrogen compound
Hydrocarbon derivative
Aromatic heteromonocyclic compound

Molecular Framework

Aromatic heteromonocyclic 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

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

Not Available

METLIN ID

Not Available

PubChem Compound

102067822

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Smith TE, Kuo WH, Balskus EP, Bock VD, Roizen JL, Theberge AB, Carroll KA, Kurihara T, Wessler JD: Total synthesis of (-)-hennoxazole A. J Org Chem. 2008 Jan 4;73(1):142-50. doi: 10.1021/jo7018015. Epub 2007 Dec 6. [PubMed:18052386 ]
Smith TE, Kuo WH, Bock VD, Roizen JL, Balskus EP, Theberge AB: Total synthesis of (-)-hennoxazole A. Org Lett. 2007 Mar 15;9(6):1153-5. doi: 10.1021/ol070244p. Epub 2007 Feb 23. [PubMed:17316014 ]
LOTUS database [Link]

Showing NP-Card for (2r,4r,6r)-6-[(2r)-2-(2-{2-[(3e,6e,8s,9e)-6,8-dimethylundeca-3,6,9-trien-1-yl]-1,3-oxazol-4-yl}-1,3-oxazol-4-yl)-2-methoxyethyl]-2-methoxy-2-methyloxan-4-ol (NP0236707)

MOL for NP0236707 ((2r,4r,6r)-6-[(2r)-2-(2-{2-[(3e,6e,8s,9e)-6,8-dimethylundeca-3,6,9-trien-1-yl]-1,3-oxazol-4-yl}-1,3-oxazol-4-yl)-2-methoxyethyl]-2-methoxy-2-methyloxan-4-ol)

3D MOL for NP0236707 ((2r,4r,6r)-6-[(2r)-2-(2-{2-[(3e,6e,8s,9e)-6,8-dimethylundeca-3,6,9-trien-1-yl]-1,3-oxazol-4-yl}-1,3-oxazol-4-yl)-2-methoxyethyl]-2-methoxy-2-methyloxan-4-ol)

3D SDF for NP0236707 ((2r,4r,6r)-6-[(2r)-2-(2-{2-[(3e,6e,8s,9e)-6,8-dimethylundeca-3,6,9-trien-1-yl]-1,3-oxazol-4-yl}-1,3-oxazol-4-yl)-2-methoxyethyl]-2-methoxy-2-methyloxan-4-ol)

3D-SDF for NP0236707 ((2r,4r,6r)-6-[(2r)-2-(2-{2-[(3e,6e,8s,9e)-6,8-dimethylundeca-3,6,9-trien-1-yl]-1,3-oxazol-4-yl}-1,3-oxazol-4-yl)-2-methoxyethyl]-2-methoxy-2-methyloxan-4-ol)

PDB for NP0236707 ((2r,4r,6r)-6-[(2r)-2-(2-{2-[(3e,6e,8s,9e)-6,8-dimethylundeca-3,6,9-trien-1-yl]-1,3-oxazol-4-yl}-1,3-oxazol-4-yl)-2-methoxyethyl]-2-methoxy-2-methyloxan-4-ol)

3D PDB for NP0236707 ((2r,4r,6r)-6-[(2r)-2-(2-{2-[(3e,6e,8s,9e)-6,8-dimethylundeca-3,6,9-trien-1-yl]-1,3-oxazol-4-yl}-1,3-oxazol-4-yl)-2-methoxyethyl]-2-methoxy-2-methyloxan-4-ol)

SMILES for NP0236707 ((2r,4r,6r)-6-[(2r)-2-(2-{2-[(3e,6e,8s,9e)-6,8-dimethylundeca-3,6,9-trien-1-yl]-1,3-oxazol-4-yl}-1,3-oxazol-4-yl)-2-methoxyethyl]-2-methoxy-2-methyloxan-4-ol)

INCHI for NP0236707 ((2r,4r,6r)-6-[(2r)-2-(2-{2-[(3e,6e,8s,9e)-6,8-dimethylundeca-3,6,9-trien-1-yl]-1,3-oxazol-4-yl}-1,3-oxazol-4-yl)-2-methoxyethyl]-2-methoxy-2-methyloxan-4-ol)

Structure for NP0236707 ((2r,4r,6r)-6-[(2r)-2-(2-{2-[(3e,6e,8s,9e)-6,8-dimethylundeca-3,6,9-trien-1-yl]-1,3-oxazol-4-yl}-1,3-oxazol-4-yl)-2-methoxyethyl]-2-methoxy-2-methyloxan-4-ol)

3D Structure for NP0236707 ((2r,4r,6r)-6-[(2r)-2-(2-{2-[(3e,6e,8s,9e)-6,8-dimethylundeca-3,6,9-trien-1-yl]-1,3-oxazol-4-yl}-1,3-oxazol-4-yl)-2-methoxyethyl]-2-methoxy-2-methyloxan-4-ol)