NP-MRD: Showing NP-Card for Kedarcidin (NP0139110)

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Record Information

Version

2.0

Created at

2022-06-29 19:39:46 UTC

Updated at

2022-06-29 19:39:46 UTC

NP-MRD ID

NP0139110

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Kedarcidin

Description

Kedarcidin belongs to the class of organic compounds known as aminoglycosides. These are molecules or a portion of a molecule composed of amino-modified sugars. Kedarcidin was first documented in 2013 (PMID: 23633564). Based on a literature review a small amount of articles have been published on Kedarcidin (PMID: 23360970) (PMID: 30911163) (PMID: 26177844) (PMID: 23844627).

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1652306292221392D          

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M  END

     RDKit          3D

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M  END


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M  END
> <DATABASE_ID>
NP0139110

> <DATABASE_NAME>
NP-MRD

> <SMILES>
COC1=C(OC)C2=CC(C(=O)NC3CC4=NC(Cl)=C(OC5C=C6C#C\C(=C/C#CC7OC67C5OC5CC(C)(O)C(O)C(C)O5)C(COC3=O)OC3CC(O)C(C(C)O3)N(C)C)C=C4)=C(O)C=C2C=C1OC(C)C

> <INCHI_IDENTIFIER>
InChI=1S/C53H60ClN3O16/c1-25(2)67-38-18-29-17-35(58)33(21-32(29)45(64-8)46(38)65-9)50(61)56-34-20-31-15-16-37(49(54)55-31)70-39-19-30-14-13-28(40(24-66-51(34)62)71-42-22-36(59)44(57(6)7)26(3)68-42)11-10-12-41-53(30,73-41)48(39)72-43-23-52(5,63)47(60)27(4)69-43/h11,15-19,21,25-27,34,36,39-44,47-48,58-60,63H,20,22-24H2,1-9H3,(H,56,61)/b28-11+

> <INCHI_KEY>
GFTRTMUGNRZABD-IPBVOBEMSA-N

> <FORMULA>
C53H60ClN3O16

> <MOLECULAR_WEIGHT>
1030.52

> <EXACT_MASS>
1029.3662106

> <JCHEM_ACCEPTOR_COUNT>
17

> <JCHEM_ATOM_COUNT>
133

> <JCHEM_AVERAGE_POLARIZABILITY>
104.82119950555176

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
5

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
N-[(15E)-6-chloro-24-[(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy]-14-{[5-(dimethylamino)-4-hydroxy-6-methyloxan-2-yl]oxy}-11-oxo-4,12,20-trioxa-7-azapentacyclo[13.6.2.2^{5,8}.1^{3,21}.0^{19,21}]hexacosa-1,5,7,15,25-pentaen-17,22-diyn-10-yl]-3-hydroxy-7,8-dimethoxy-6-(propan-2-yloxy)naphthalene-2-carboxamide

> <ALOGPS_LOGP>
3.86

> <JCHEM_LOGP>
3.7243813625548436

> <ALOGPS_LOGS>
-4.84

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
9

> <JCHEM_PHYSIOLOGICAL_CHARGE>
1

> <JCHEM_PKA>
12.980238243204383

> <JCHEM_PKA_STRONGEST_ACIDIC>
7.863529408067283

> <JCHEM_PKA_STRONGEST_BASIC>
8.820052088544958

> <JCHEM_POLAR_SURFACE_AREA>
238.81999999999996

> <JCHEM_REFRACTIVITY>
262.9507000000001

> <JCHEM_ROTATABLE_BOND_COUNT>
11

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.48e-02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
N-[(15E)-6-chloro-24-[(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy]-14-{[5-(dimethylamino)-4-hydroxy-6-methyloxan-2-yl]oxy}-11-oxo-4,12,20-trioxa-7-azapentacyclo[13.6.2.2^{5,8}.1^{3,21}.0^{19,21}]hexacosa-1,5,7,15,25-pentaen-17,22-diyn-10-yl]-3-hydroxy-6-isopropoxy-7,8-dimethoxynaphthalene-2-carboxamide

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 29-JUN-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   29-JUN-22         0                                  
HETATM    1  C   UNK     0       8.353   8.981   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       9.160   7.670   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      10.699   7.713   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      11.506   6.401   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      10.774   5.046   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       9.235   5.003   0.000  0.00  0.00           C+0
HETATM    7  O   UNK     0       8.428   6.315   0.000  0.00  0.00           O+0
HETATM    8  O   UNK     0       8.502   3.649   0.000  0.00  0.00           O+0
HETATM    9  C   UNK     0       9.309   2.337   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      10.824   2.780   0.000  0.00  0.00           C+0
HETATM   11  O   UNK     0      12.392   2.598   0.000  0.00  0.00           O+0
HETATM   12  C   UNK     0      13.791   1.878   0.000  0.00  0.00           C+0
HETATM   13  O   UNK     0      14.729   3.100   0.000  0.00  0.00           O+0
HETATM   14  C   UNK     0      14.860   0.701   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      15.437  -0.779   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      15.148  -2.365   0.000  0.00  0.00           C+0
HETATM   17  N   UNK     0      13.643  -1.998   0.000  0.00  0.00           N+0
HETATM   18  C   UNK     0      12.538  -3.080   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      12.862  -4.615   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      14.381  -5.024   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      15.510  -3.906   0.000  0.00  0.00           C+0
HETATM   22  O   UNK     0      11.343  -5.234   0.000  0.00  0.00           O+0
HETATM   23  C   UNK     0       9.713  -5.125   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      10.177  -3.658   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0       8.983  -2.682   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0       9.724  -1.326   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0       9.405   0.175   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0       8.221   1.173   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0       6.659   1.091   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0       5.493   0.073   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0       5.274  -1.469   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0       6.125  -2.773   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0       7.591  -3.434   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0       8.131  -4.974   0.000  0.00  0.00           C+0
HETATM   35  O   UNK     0       7.181  -6.186   0.000  0.00  0.00           O+0
HETATM   36  C   UNK     0       5.656  -5.970   0.000  0.00  0.00           C+0
HETATM   37  C   UNK     0       5.081  -4.541   0.000  0.00  0.00           C+0
HETATM   38  C   UNK     0       3.557  -4.325   0.000  0.00  0.00           C+0
HETATM   39  C   UNK     0       2.607  -5.537   0.000  0.00  0.00           C+0
HETATM   40  C   UNK     0       3.182  -6.966   0.000  0.00  0.00           C+0
HETATM   41  O   UNK     0       4.707  -7.182   0.000  0.00  0.00           O+0
HETATM   42  C   UNK     0       2.232  -8.178   0.000  0.00  0.00           C+0
HETATM   43  O   UNK     0       1.082  -5.321   0.000  0.00  0.00           O+0
HETATM   44  C   UNK     0       3.719  -2.794   0.000  0.00  0.00           C+0
HETATM   45  O   UNK     0       2.378  -3.334   0.000  0.00  0.00           O+0
HETATM   46  O   UNK     0       6.238  -4.288   0.000  0.00  0.00           O+0
HETATM   47 Cl   UNK     0      11.064  -2.633   0.000  0.00  0.00          Cl+0
HETATM   48  N   UNK     0      16.169   1.512   0.000  0.00  0.00           N+0
HETATM   49  C   UNK     0      17.526   0.783   0.000  0.00  0.00           C+0
HETATM   50  O   UNK     0      17.573  -0.756   0.000  0.00  0.00           O+0
HETATM   51  C   UNK     0      18.835   1.594   0.000  0.00  0.00           C+0
HETATM   52  C   UNK     0      20.192   0.865   0.000  0.00  0.00           C+0
HETATM   53  C   UNK     0      21.501   1.676   0.000  0.00  0.00           C+0
HETATM   54  C   UNK     0      21.454   3.215   0.000  0.00  0.00           C+0
HETATM   55  C   UNK     0      22.763   4.026   0.000  0.00  0.00           C+0
HETATM   56  C   UNK     0      22.716   5.565   0.000  0.00  0.00           C+0
HETATM   57  C   UNK     0      21.359   6.294   0.000  0.00  0.00           C+0
HETATM   58  C   UNK     0      20.050   5.483   0.000  0.00  0.00           C+0
HETATM   59  C   UNK     0      20.097   3.944   0.000  0.00  0.00           C+0
HETATM   60  C   UNK     0      18.788   3.133   0.000  0.00  0.00           C+0
HETATM   61  O   UNK     0      18.693   6.212   0.000  0.00  0.00           O+0
HETATM   62  C   UNK     0      17.384   5.401   0.000  0.00  0.00           C+0
HETATM   63  O   UNK     0      21.312   7.833   0.000  0.00  0.00           O+0
HETATM   64  C   UNK     0      19.955   8.561   0.000  0.00  0.00           C+0
HETATM   65  O   UNK     0      24.025   6.376   0.000  0.00  0.00           O+0
HETATM   66  C   UNK     0      23.978   7.915   0.000  0.00  0.00           C+0
HETATM   67  C   UNK     0      25.287   8.726   0.000  0.00  0.00           C+0
HETATM   68  C   UNK     0      22.621   8.644   0.000  0.00  0.00           C+0
HETATM   69  O   UNK     0      20.239  -0.674   0.000  0.00  0.00           O+0
HETATM   70  O   UNK     0      13.046   6.444   0.000  0.00  0.00           O+0
HETATM   71  N   UNK     0      11.432   9.067   0.000  0.00  0.00           N+0
HETATM   72  C   UNK     0      12.971   9.111   0.000  0.00  0.00           C+0
HETATM   73  C   UNK     0      10.625  10.379   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3    7                                                  
CONECT    3    2    4   71                                                  
CONECT    4    3    5   70                                                  
CONECT    5    4    6                                                       
CONECT    6    5    7    8                                                  
CONECT    7    6    2                                                       
CONECT    8    6    9                                                       
CONECT    9    8   10   28                                                  
CONECT   10    9   11                                                       
CONECT   11   10   12                                                       
CONECT   12   11   13   14                                                  
CONECT   13   12                                                            
CONECT   14   12   15   48                                                  
CONECT   15   14   16                                                       
CONECT   16   15   17   21                                                  
CONECT   17   16   18                                                       
CONECT   18   17   19   47                                                  
CONECT   19   18   20   22                                                  
CONECT   20   19   21                                                       
CONECT   21   20   16                                                       
CONECT   22   19   23                                                       
CONECT   23   22   24   34                                                  
CONECT   24   23   25                                                       
CONECT   25   24   26   33                                                  
CONECT   26   25   27                                                       
CONECT   27   26   28                                                       
CONECT   28   27    9   29                                                  
CONECT   29   28   30                                                       
CONECT   30   29   31                                                       
CONECT   31   30   32                                                       
CONECT   32   31   33   46                                                  
CONECT   33   32   25   34   46                                             
CONECT   34   33   23   35                                                  
CONECT   35   34   36                                                       
CONECT   36   35   37   41                                                  
CONECT   37   36   38                                                       
CONECT   38   37   39   44   45                                             
CONECT   39   38   40   43                                                  
CONECT   40   39   41   42                                                  
CONECT   41   40   36                                                       
CONECT   42   40                                                            
CONECT   43   39                                                            
CONECT   44   38                                                            
CONECT   45   38                                                            
CONECT   46   33   32                                                       
CONECT   47   18                                                            
CONECT   48   14   49                                                       
CONECT   49   48   50   51                                                  
CONECT   50   49                                                            
CONECT   51   49   52   60                                                  
CONECT   52   51   53   69                                                  
CONECT   53   52   54                                                       
CONECT   54   53   55   59                                                  
CONECT   55   54   56                                                       
CONECT   56   55   57   65                                                  
CONECT   57   56   58   63                                                  
CONECT   58   57   59   61                                                  
CONECT   59   58   54   60                                                  
CONECT   60   59   51                                                       
CONECT   61   58   62                                                       
CONECT   62   61                                                            
CONECT   63   57   64                                                       
CONECT   64   63                                                            
CONECT   65   56   66                                                       
CONECT   66   65   67   68                                                  
CONECT   67   66                                                            
CONECT   68   66                                                            
CONECT   69   52                                                            
CONECT   70    4                                                            
CONECT   71    3   72   73                                                  
CONECT   72   71                                                            
CONECT   73   71                                                            
MASTER        0    0    0    0    0    0    0    0   73    0  162    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₅₃H₆₀ClN₃O₁₆

Average Mass

1030.5200 Da

Monoisotopic Mass

1029.36621 Da

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

COC1=C(OC)C2=CC(C(=O)NC3CC4=NC(Cl)=C(OC5C=C6C#C\C(=C/C#CC7OC67C5OC5CC(C)(O)C(O)C(C)O5)C(COC3=O)OC3CC(O)C(C(C)O3)N(C)C)C=C4)=C(O)C=C2C=C1OC(C)C

InChI Identifier

InChI=1S/C53H60ClN3O16/c1-25(2)67-38-18-29-17-35(58)33(21-32(29)45(64-8)46(38)65-9)50(61)56-34-20-31-15-16-37(49(54)55-31)70-39-19-30-14-13-28(40(24-66-51(34)62)71-42-22-36(59)44(57(6)7)26(3)68-42)11-10-12-41-53(30,73-41)48(39)72-43-23-52(5,63)47(60)27(4)69-43/h11,15-19,21,25-27,34,36,39-44,47-48,58-60,63H,20,22-24H2,1-9H3,(H,56,61)/b28-11+

InChI Key

GFTRTMUGNRZABD-IPBVOBEMSA-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

Description

Belongs to the class of organic compounds known as aminoglycosides. These are molecules or a portion of a molecule composed of amino-modified sugars.

Kingdom

Organic compounds

Super Class

Organic oxygen compounds

Class

Organooxygen compounds

Sub Class

Carbohydrates and carbohydrate conjugates

Direct Parent

Aminoglycosides

Alternative Parents

Substituents

Aminoglycoside core
Alpha-amino acid ester
2-naphthalenecarboxylic acid or derivatives
2-naphthalenecarboxamide
N-acyl-alpha amino acid or derivatives
O-glycosyl compound
2-naphthol
Glycosyl compound
Naphthalene
Salicylic acid or derivatives
Alpha-amino acid or derivatives
Anisole
Alkyl aryl ether
1-hydroxy-2-unsubstituted benzenoid
2-halopyridine
Benzenoid
Monosaccharide
Pyridine
Oxane
Aryl halide
Aryl chloride
Tertiary alcohol
Heteroaromatic compound
Vinylogous acid
1,2-aminoalcohol
Amino acid or derivatives
Carboxamide group
Carboxylic acid ester
Tertiary aliphatic amine
Lactone
Tertiary amine
Secondary carboxylic acid amide
Secondary alcohol
Ether
Oxirane
Dialkyl ether
Acetal
Carboxylic acid derivative
Monocarboxylic acid or derivatives
Oxacycle
Organoheterocyclic compound
Azacycle
Organohalogen compound
Carbonyl group
Organopnictogen compound
Organic oxide
Alcohol
Amine
Organic nitrogen compound
Hydrocarbon derivative
Organonitrogen compound
Organochloride
Aromatic heteropolycyclic compound

Molecular Framework

Aromatic heteropolycyclic 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

4978668

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Kedarcidin

METLIN ID

Not Available

PubChem Compound

6477354

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Huang SX, Lohman JR, Huang T, Shen B: A new member of the 4-methylideneimidazole-5-one-containing aminomutase family from the enediyne kedarcidin biosynthetic pathway. Proc Natl Acad Sci U S A. 2013 May 14;110(20):8069-74. doi: 10.1073/pnas.1304733110. Epub 2013 Apr 30. [PubMed:23633564 ]
Lohman JR, Huang SX, Horsman GP, Dilfer PE, Huang T, Chen Y, Wendt-Pienkowski E, Shen B: Cloning and sequencing of the kedarcidin biosynthetic gene cluster from Streptoalloteichus sp. ATCC 53650 revealing new insights into biosynthesis of the enediyne family of antitumor antibiotics. Mol Biosyst. 2013 Mar;9(3):478-91. doi: 10.1039/c3mb25523a. Epub 2013 Jan 29. [PubMed:23360970 ]
Lear MJ, Hirai K, Ogawa K, Yamashita S, Hirama M: A convergent total synthesis of the kedarcidin chromophore: 20-years in the making. J Antibiot (Tokyo). 2019 Jun;72(6):350-363. doi: 10.1038/s41429-019-0175-y. Epub 2019 Mar 25. [PubMed:30911163 ]
Delvaux NA, Thoden JB, Holden HM: Molecular architecture of KedS8, a sugar N-methyltransferase from Streptoalloteichus sp. ATCC 53650. Protein Sci. 2015 Oct;24(10):1593-9. doi: 10.1002/pro.2742. Epub 2015 Jul 21. [PubMed:26177844 ]
Horsman GP, Lechner A, Ohnishi Y, Moore BS, Shen B: Predictive model for epoxide hydrolase-generated stereochemistry in the biosynthesis of nine-membered enediyne antitumor antibiotics. Biochemistry. 2013 Aug 6;52(31):5217-24. doi: 10.1021/bi400572a. Epub 2013 Jul 23. [PubMed:23844627 ]

Showing NP-Card for Kedarcidin (NP0139110)

MOL for NP0139110 (Kedarcidin)

3D MOL for NP0139110 (Kedarcidin)

3D SDF for NP0139110 (Kedarcidin)

3D-SDF for NP0139110 (Kedarcidin)

PDB for NP0139110 (Kedarcidin)

3D PDB for NP0139110 (Kedarcidin)

SMILES for NP0139110 (Kedarcidin)

INCHI for NP0139110 (Kedarcidin)

Structure for NP0139110 (Kedarcidin)

3D Structure for NP0139110 (Kedarcidin)