NP-MRD: Showing NP-Card for Aquacobalamin (NP0087058)

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Record Information

Version

2.0

Created at

2022-05-11 16:38:46 UTC

Updated at

2022-05-11 16:38:46 UTC

NP-MRD ID

NP0087058

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Aquacobalamin

Description

Aquacobalamin belongs to the class of organic compounds known as lineolic acids and derivatives. These are derivatives of lineolic acid. Lineolic acid is a polyunsaturated omega-6 18 carbon long fatty acid, with two CC double bonds at the 9- and 12-positions. Aquacobalamin is possibly neutral.

Structure

MOL SDF PDB SMILES InChI


  Mrv0541 02251206292D          

101112  0  0  1  0            999 V2000
    2.8139   -2.3657    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1460   -1.5847    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
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M  CHG  1  46   1
M  RAD  4  22   2  26   2  31   2  48   2
M  END


  Mrv0541 02251206292D          

101112  0  0  1  0            999 V2000
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 87101  1  6  0  0  0
M  CHG  1  46   1
M  RAD  4  22   2  26   2  31   2  48   2
M  END
> <DATABASE_ID>
NP0087058

> <DATABASE_NAME>
NP-MRD

> <SMILES>
C([C@@]1([H])C2N3[Co+]456([N]7=CN([C@@]8([H])O[C@@]([H])([C@](OP(O[C@](CNC(CC[C@@]1(C)C3=C(C)C1=[N]4C(=CC3=[N]5C(=C(C)C4=[N]6[C@]2(C)[C@@](CC(N)=O)([C@]4([H])CCC(N)=O)C)[C@@](CC(N)=O)([C@]3([H])CCC(N)=O)C)C([C@]1([H])CCC(N)=O)(C)C)=O)([H])C)(O)=O)([H])[C@@]8([H])O)CO)C1=C7C=C(C)C(C)=C1)O)C(N)=O

> <INCHI_IDENTIFIER>
InChI=1S/C62H89N13O14P.Co.H2O/c1-29-20-39-40(21-30(29)2)75(28-70-39)57-52(84)53(41(27-76)87-57)89-90(85,86)88-31(3)26-69-49(83)18-19-59(8)37(22-46(66)80)56-62(11)61(10,25-48(68)82)36(14-17-45(65)79)51(74-62)33(5)55-60(9,24-47(67)81)34(12-15-43(63)77)38(71-55)23-42-58(6,7)35(13-16-44(64)78)50(72-42)32(4)54(59)73-56;;/h20-21,23,28,31,34-37,41,52-53,56-57,76,84H,12-19,22,24-27H2,1-11H3,(H2,63,77)(H2,64,78)(H2,65,79)(H2,66,80)(H2,67,81)(H2,68,82)(H,69,83)(H,85,86);;1H2/q-1;+3;/p-1/b54-32-;;/t31-,34-,35-,36-,37+,41-,52-,53-,56?,57+,59-,60+,61+,62+;;/m1../s1

> <INCHI_KEY>
XVXCLEXSDVMESA-RKRHPEFLSA-M

> <FORMULA>
C62H90CoN13O15P

> <MOLECULAR_WEIGHT>
1347.3631

> <EXACT_MASS>
1346.574895981

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_AVERAGE_POLARIZABILITY>
135.39604504368805

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
1

> <JCHEM_GHOSE_FILTER>
0

> <ALOGPS_LOGP>
1.09

> <ALOGPS_LOGS>
-4.90

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
12

> <JCHEM_PHYSIOLOGICAL_CHARGE>
1

> <JCHEM_POLAR_SURFACE_AREA>
496.64000000000004

> <JCHEM_REFRACTIVITY>
352.1363000000001

> <JCHEM_ROTATABLE_BOND_COUNT>
16

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.76e-02 g/l

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 25-FEB-12   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   25-FEB-12         0                                  
HETATM    1  C   UNK     0       5.253  -4.416   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       5.872  -2.958   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       4.926  -1.743   0.000  0.00  0.00           C+0
HETATM    4  N   UNK     0       3.401  -1.955   0.000  0.00  0.00           N+0
HETATM    5  C   UNK     0       2.455  -0.740   0.000  0.00  0.00           C+0
HETATM    6  O   UNK     0       3.061   0.718   0.000  0.00  0.00           O+0
HETATM    7  C   UNK     0       0.930  -0.952   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -0.016   0.262   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      -1.541   0.051   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      -0.878   1.542   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -2.609   1.160   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      -2.336   2.746   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      -3.514   3.794   0.000  0.00  0.00           C+0
HETATM   14  N   UNK     0      -4.975   3.309   0.000  0.00  0.00           N+0
HETATM   15  O   UNK     0      -3.203   5.302   0.000  0.00  0.00           O+0
HETATM   16  C   UNK     0      -3.994   0.487   0.000  0.00  0.00           C+0
HETATM   17  N   UNK     0      -3.782  -1.038   0.000  0.00  0.00           N+0
HETATM   18  C   UNK     0      -2.266  -1.308   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      -1.693  -3.208   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      -0.098  -2.919   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      -2.120  -4.688   0.000  0.00  0.00           C+0
HETATM   22  N   UNK     0      -3.659  -4.739   0.000  0.00  0.00           N+0
HETATM   23  C   UNK     0      -4.086  -6.219   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      -6.035  -6.590   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      -7.462  -6.011   0.000  0.00  0.00           C+0
HETATM   26  N   UNK     0      -7.352  -4.475   0.000  0.00  0.00           N+0
HETATM   27  C   UNK     0      -8.779  -3.896   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0      -8.945  -1.918   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0     -10.463  -1.572   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0      -8.220  -0.560   0.000  0.00  0.00           C+0
HETATM   31  N   UNK     0      -6.704  -0.830   0.000  0.00  0.00           N+0
HETATM   32  C   UNK     0      -5.979   0.529   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0      -4.958   1.727   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0      -7.047   1.638   0.000  0.00  0.00           C+0
HETATM   35  C   UNK     0      -6.287   2.992   0.000  0.00  0.00           C+0
HETATM   36  C   UNK     0      -7.915   3.019   0.000  0.00  0.00           C+0
HETATM   37  C   UNK     0      -7.240   4.470   0.000  0.00  0.00           C+0
HETATM   38  N   UNK     0      -8.124   5.730   0.000  0.00  0.00           N+0
HETATM   39  O   UNK     0      -5.706   4.605   0.000  0.00  0.00           O+0
HETATM   40  C   UNK     0      -8.432   0.965   0.000  0.00  0.00           C+0
HETATM   41  C   UNK     0      -9.863   1.701   0.000  0.00  0.00           C+0
HETATM   42  C   UNK     0     -11.209   0.909   0.000  0.00  0.00           C+0
HETATM   43  C   UNK     0     -12.549   1.667   0.000  0.00  0.00           C+0
HETATM   44  N   UNK     0     -12.562   3.207   0.000  0.00  0.00           N+0
HETATM   45  O   UNK     0     -13.876   0.886   0.000  0.00  0.00           O+0
HETATM   46 Co   UNK     0      -1.015  -3.853   0.000  0.00  0.00          Co+1
HETATM   47  O   UNK     0      -0.481  -5.284   0.000  0.00  0.00           O+0
HETATM   48  N   UNK     0      16.421  -8.183   0.000  0.00  0.00           N+0
HETATM   49  C   UNK     0      14.882  -8.234   0.000  0.00  0.00           C+0
HETATM   50  N   UNK     0      14.358  -6.787   0.000  0.00  0.00           N+0
HETATM   51  C   UNK     0      12.878  -6.360   0.000  0.00  0.00           C+0
HETATM   52  O   UNK     0      11.663  -7.306   0.000  0.00  0.00           O+0
HETATM   53  C   UNK     0      10.388  -6.443   0.000  0.00  0.00           C+0
HETATM   54  C   UNK     0       8.901  -6.939   0.000  0.00  0.00           C+0
HETATM   55  O   UNK     0       8.653  -8.587   0.000  0.00  0.00           O+0
HETATM   56  C   UNK     0      10.815  -4.964   0.000  0.00  0.00           C+0
HETATM   57  O   UNK     0       9.869  -3.749   0.000  0.00  0.00           O+0
HETATM   58  P   UNK     0       8.344  -3.961   0.000  0.00  0.00           P+0
HETATM   59  O   UNK     0       8.423  -2.555   0.000  0.00  0.00           O+0
HETATM   60  O   UNK     0       9.025  -2.445   0.000  0.00  0.00           O+0
HETATM   61  O   UNK     0       7.397  -2.746   0.000  0.00  0.00           O+0
HETATM   62  C   UNK     0      12.354  -4.912   0.000  0.00  0.00           C+0
HETATM   63  O   UNK     0      13.229  -3.527   0.000  0.00  0.00           O+0
HETATM   64  C   UNK     0      15.573  -5.840   0.000  0.00  0.00           C+0
HETATM   65  C   UNK     0      16.848  -6.704   0.000  0.00  0.00           C+0
HETATM   66  C   UNK     0      18.233  -6.031   0.000  0.00  0.00           C+0
HETATM   67  C   UNK     0      18.343  -4.495   0.000  0.00  0.00           C+0
HETATM   68  C   UNK     0      19.828  -3.801   0.000  0.00  0.00           C+0
HETATM   69  C   UNK     0      17.067  -3.632   0.000  0.00  0.00           C+0
HETATM   70  C   UNK     0      17.167  -2.051   0.000  0.00  0.00           C+0
HETATM   71  C   UNK     0      15.682  -4.305   0.000  0.00  0.00           C+0
HETATM   72  C   UNK     0      -9.771  -5.074   0.000  0.00  0.00           C+0
HETATM   73  C   UNK     0     -10.922  -4.002   0.000  0.00  0.00           C+0
HETATM   74  C   UNK     0     -11.094  -6.052   0.000  0.00  0.00           C+0
HETATM   75  C   UNK     0     -12.566  -5.447   0.000  0.00  0.00           C+0
HETATM   76  N   UNK     0     -13.785  -6.387   0.000  0.00  0.00           N+0
HETATM   77  O   UNK     0     -12.771  -3.921   0.000  0.00  0.00           O+0
HETATM   78  C   UNK     0      -8.957  -6.381   0.000  0.00  0.00           C+0
HETATM   79  C   UNK     0      -9.581  -7.829   0.000  0.00  0.00           C+0
HETATM   80  C   UNK     0      -8.538  -9.137   0.000  0.00  0.00           C+0
HETATM   81  C   UNK     0      -9.101 -10.571   0.000  0.00  0.00           C+0
HETATM   82  N   UNK     0      -8.141 -11.775   0.000  0.00  0.00           N+0
HETATM   83  O   UNK     0     -10.623 -10.800   0.000  0.00  0.00           O+0
HETATM   84  C   UNK     0      -2.810  -7.082   0.000  0.00  0.00           C+0
HETATM   85  C   UNK     0      -1.868  -8.349   0.000  0.00  0.00           C+0
HETATM   86  C   UNK     0      -3.812  -8.338   0.000  0.00  0.00           C+0
HETATM   87  C   UNK     0      -1.595  -6.135   0.000  0.00  0.00           C+0
HETATM   88  C   UNK     0      -0.039  -6.656   0.000  0.00  0.00           C+0
HETATM   89  C   UNK     0       0.482  -8.199   0.000  0.00  0.00           C+0
HETATM   90  C   UNK     0       1.992  -8.503   0.000  0.00  0.00           C+0
HETATM   91  N   UNK     0       3.009  -7.347   0.000  0.00  0.00           N+0
HETATM   92  O   UNK     0       2.484  -9.962   0.000  0.00  0.00           O+0
HETATM   93  H   UNK     0       5.857  -1.297   0.000  0.00  0.00           H+0
HETATM   94  H   UNK     0      -1.472   2.842   0.000  0.00  0.00           H+0
HETATM   95  H   UNK     0      -9.307  -0.438   0.000  0.00  0.00           H+0
HETATM   96  H   UNK     0      13.209  -4.656   0.000  0.00  0.00           H+0
HETATM   97  H   UNK     0       9.125  -5.705   0.000  0.00  0.00           H+0
HETATM   98  H   UNK     0      12.099  -3.974   0.000  0.00  0.00           H+0
HETATM   99  H   UNK     0      13.689  -5.762   0.000  0.00  0.00           H+0
HETATM  100  H   UNK     0      -8.382  -7.752   0.000  0.00  0.00           H+0
HETATM  101  H   UNK     0      -1.147  -4.699   0.000  0.00  0.00           H+0
CONECT    1    2                                                            
CONECT    2    1    3   61   93                                             
CONECT    3    2    4                                                       
CONECT    4    3    5                                                       
CONECT    5    4    6    7                                                  
CONECT    6    5                                                            
CONECT    7    5    8                                                       
CONECT    8    7    9                                                       
CONECT    9    8   10   11   18                                             
CONECT   10    9                                                            
CONECT   11    9   12   16   94                                             
CONECT   12   11   13                                                       
CONECT   13   12   14   15                                                  
CONECT   14   13                                                            
CONECT   15   13                                                            
CONECT   16   11   17   32                                                  
CONECT   17   16   18   46                                                  
CONECT   18   17    9   19                                                  
CONECT   19   18   20   21                                                  
CONECT   20   19                                                            
CONECT   21   19   22   87                                                  
CONECT   22   21   23   46                                                  
CONECT   23   22   24   84                                                  
CONECT   24   23   25                                                       
CONECT   25   24   26   78                                                  
CONECT   26   25   27   46                                                  
CONECT   27   26   28   72                                                  
CONECT   28   27   29   30                                                  
CONECT   29   28                                                            
CONECT   30   28   31   40                                                  
CONECT   31   30   32   46                                                  
CONECT   32   31   16   33   34                                             
CONECT   33   32                                                            
CONECT   34   32   35   36   40                                             
CONECT   35   34                                                            
CONECT   36   34   37                                                       
CONECT   37   36   38   39                                                  
CONECT   38   37                                                            
CONECT   39   37                                                            
CONECT   40   34   30   41   95                                             
CONECT   41   40   42                                                       
CONECT   42   41   43                                                       
CONECT   43   42   44   45                                                  
CONECT   44   43                                                            
CONECT   45   43                                                            
CONECT   46   31   17   22   26                                             
CONECT   46   47   48                                   
CONECT   47   46                                                            
CONECT   48   46   49   65                                                  
CONECT   49   48   50                                                       
CONECT   50   49   51   64                                                  
CONECT   51   50   52   62   96                                             
CONECT   52   51   53                                                       
CONECT   53   52   54   56   97                                             
CONECT   54   53   55                                                       
CONECT   55   54                                                            
CONECT   56   53   57   62   98                                             
CONECT   57   56   58                                                       
CONECT   58   57   59   60   61                                             
CONECT   59   58                                                            
CONECT   60   58                                                            
CONECT   61   58    2                                                       
CONECT   62   56   51   63   99                                             
CONECT   63   62                                                            
CONECT   64   50   65   71                                                  
CONECT   65   64   48   66                                                  
CONECT   66   65   67                                                       
CONECT   67   66   68   69                                                  
CONECT   68   67                                                            
CONECT   69   67   70   71                                                  
CONECT   70   69                                                            
CONECT   71   69   64                                                       
CONECT   72   27   73   74   78                                             
CONECT   73   72                                                            
CONECT   74   72   75                                                       
CONECT   75   74   76   77                                                  
CONECT   76   75                                                            
CONECT   77   75                                                            
CONECT   78   72   25   79  100                                             
CONECT   79   78   80                                                       
CONECT   80   79   81                                                       
CONECT   81   80   82   83                                                  
CONECT   82   81                                                            
CONECT   83   81                                                            
CONECT   84   23   85   86   87                                             
CONECT   85   84                                                            
CONECT   86   84                                                            
CONECT   87   84   21   88  101                                             
CONECT   88   87   89                                                       
CONECT   89   88   90                                                       
CONECT   90   89   91   92                                                  
CONECT   91   90                                                            
CONECT   92   90                                                            
CONECT   93    2                                                            
CONECT   94   11                                                            
CONECT   95   40                                                            
CONECT   96   51                                                            
CONECT   97   53                                                            
CONECT   98   56                                                            
CONECT   99   62                                                            
CONECT  100   78                                                            
CONECT  101   87                                                            
MASTER        0    0    0    0    0    0    0    0  101    0  224    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₆₂H₉₀CoN₁₃O₁₅P

Average Mass

1347.3631 Da

Monoisotopic Mass

1346.57490 Da

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

C([C@@]1([H])C2N3[Co+]456([N]7=CN([C@@]8([H])O[C@@]([H])([C@](OP(O[C@](CNC(CC[C@@]1(C)C3=C(C)C1=[N]4C(=CC3=[N]5C(=C(C)C4=[N]6[C@]2(C)[C@@](CC(N)=O)([C@]4([H])CCC(N)=O)C)[C@@](CC(N)=O)([C@]3([H])CCC(N)=O)C)C([C@]1([H])CCC(N)=O)(C)C)=O)([H])C)(O)=O)([H])[C@@]8([H])O)CO)C1=C7C=C(C)C(C)=C1)O)C(N)=O

InChI Identifier

InChI=1S/C62H89N13O14P.Co.H2O/c1-29-20-39-40(21-30(29)2)75(28-70-39)57-52(84)53(41(27-76)87-57)89-90(85,86)88-31(3)26-69-49(83)18-19-59(8)37(22-46(66)80)56-62(11)61(10,25-48(68)82)36(14-17-45(65)79)51(74-62)33(5)55-60(9,24-47(67)81)34(12-15-43(63)77)38(71-55)23-42-58(6,7)35(13-16-44(64)78)50(72-42)32(4)54(59)73-56;;/h20-21,23,28,31,34-37,41,52-53,56-57,76,84H,12-19,22,24-27H2,1-11H3,(H2,63,77)(H2,64,78)(H2,65,79)(H2,66,80)(H2,67,81)(H2,68,82)(H,69,83)(H,85,86);;1H2/q-1;+3;/p-1/b54-32-;;/t31-,34-,35-,36-,37+,41-,52-,53-,56?,57+,59-,60+,61+,62+;;/m1../s1

InChI Key

XVXCLEXSDVMESA-RKRHPEFLSA-M

Experimental Spectra

Not Available

Predicted Spectra

Not Available

Chemical Shift Submissions

Not Available

Species

Species of Origin

Species Name	Source	Reference
Anas platyrhynchos	FooDB	FooDB
Anatidae	FooDB	FooDB
Anser anser	FooDB	FooDB
Bison bison	FooDB	FooDB
Bos taurus	FooDB	FooDB
Bos taurus X Bison bison	FooDB	FooDB
Bubalus bubalis	FooDB	FooDB
Capra aegagrus hircus	FooDB	FooDB
Cervidae	FooDB	FooDB
Cervus canadensis	FooDB	FooDB
Columba	FooDB	FooDB
Columbidae	FooDB	FooDB
Dromaius novaehollandiae	FooDB	FooDB
Equus caballus	FooDB	FooDB
Gallus gallus	FooDB	FooDB
Lagopus muta	FooDB	FooDB
Leporidae	FooDB	FooDB
Lepus timidus	FooDB	FooDB
Melanitta fusca	FooDB	FooDB
Meleagris gallopavo	FooDB	FooDB
Numida meleagris	FooDB	FooDB
Odocoileus	FooDB	FooDB
Oryctolagus	FooDB	FooDB
Ovis aries	FooDB	FooDB
Phasianidae	FooDB	FooDB
Phasianus colchicus	FooDB	FooDB
Struthio camelus	FooDB	FooDB
Sus scrofa	FooDB	FooDB
Sus scrofa domestica	FooDB	FooDB

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as lineolic acids and derivatives. These are derivatives of lineolic acid. Lineolic acid is a polyunsaturated omega-6 18 carbon long fatty acid, with two CC double bonds at the 9- and 12-positions.

Kingdom

Organic compounds

Super Class

Lipids and lipid-like molecules

Class

Fatty Acyls

Sub Class

Lineolic acids and derivatives

Direct Parent

Lineolic acids and derivatives

Alternative Parents

Substituents

Octadecanoid
1,2-acyl-sn-glycerol
Diacylglycerol
Diradylglycerol
Fatty acid ester
Glycerolipid
Dicarboxylic acid or derivatives
Carboxylic acid ester
Carboxylic acid derivative
Organooxygen compound
Hydrocarbon derivative
Organic oxygen compound
Organic oxide
Carbonyl group
Primary alcohol
Alcohol
Aliphatic acyclic compound

Molecular Framework

Aliphatic acyclic 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	1.09	ALOGPS
logS	-4.9	ALOGPS
Physiological Charge	1	ChemAxon
Hydrogen Acceptor Count	0	ChemAxon
Hydrogen Donor Count	0	ChemAxon
Polar Surface Area	496.64 Å²	ChemAxon
Rotatable Bond Count	16	ChemAxon
Refractivity	352.14 m³·mol⁻¹	ChemAxon
Polarizability	135.4 Å³	ChemAxon
Number of Rings	12	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	Yes	ChemAxon

External Links

HMDB ID

Not Available

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

FDB023178

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

Not Available

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Not Available

Showing NP-Card for Aquacobalamin (NP0087058)

MOL for NP0087058 (Aquacobalamin)

3D MOL for NP0087058 (Aquacobalamin)

3D SDF for NP0087058 (Aquacobalamin)

3D-SDF for NP0087058 (Aquacobalamin)

PDB for NP0087058 (Aquacobalamin)

3D PDB for NP0087058 (Aquacobalamin)

SMILES for NP0087058 (Aquacobalamin)

INCHI for NP0087058 (Aquacobalamin)

Structure for NP0087058 (Aquacobalamin)

3D Structure for NP0087058 (Aquacobalamin)