NP-MRD: Showing NP-Card for penaresidin b (NP0263386)

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Record Information

Version

2.0

Created at

2022-09-08 06:33:27 UTC

Updated at

2022-09-08 06:33:27 UTC

NP-MRD ID

NP0263386

Secondary Accession Numbers

None

Natural Product Identification

Common Name

penaresidin b

Description

Penaresidin b belongs to the class of organic compounds known as azetidines. These are organic compounds containing a saturated four-member heterocycle where one nitrogen atom replaces a carbon atom. Thus, penaresidin b is considered to be a sphingoid base. penaresidin b was first documented in 2007 (PMID: 17509887). Based on a literature review a small amount of articles have been published on Penaresidin b (PMID: 31873026) (PMID: 25692188).

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 62 62  0  0  0  0  0  0  0  0999 V2000
    7.3735   -0.8791   -1.0120 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5206   -0.3599    0.1296 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4419    0.3665    1.1131 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4874    0.6452   -0.3176 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5637    0.0076   -1.3264 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.3276   -0.4195   -2.4511 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8608   -1.1582   -0.7234 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0527   -0.7461    0.4668 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0189    0.2866    0.0133 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2069    0.6629    1.2456 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1839    1.6846    0.8611 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7406    1.1494   -0.2007 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4442   -0.0627    0.3161 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3932   -0.6510   -0.6983 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4336    0.3508   -1.0647 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2625    0.8256    0.1144 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9809   -0.3275    0.7676 C   0  0  2  0  0  0  0  0  0  0  0  0
   -5.8925   -1.0448   -0.0809 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8996   -0.0495    0.2419 C   0  0  1  0  0  0  0  0  0  0  0  0
   -8.2524   -0.7160    0.3307 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4935   -1.2909   -0.9363 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2007    0.1708    1.5458 C   0  0  2  0  0  0  0  0  0  0  0  0
   -6.0038    1.4737    1.9412 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9522   -1.7827   -1.4897 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5256   -0.0791   -1.7609 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3724   -1.1197   -0.5856 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0381   -1.2162    0.6296 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3993   -0.1666    1.1018 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9240    0.3595    2.0864 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5483    1.4070    0.7108 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9571    1.0078    0.5688 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0599    1.4861   -0.8083 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8715    0.7711   -1.7486 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6707   -0.7671   -3.1055 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5540   -1.9896   -0.4881 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1450   -1.5672   -1.5050 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4588   -1.6213    0.8483 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6682   -0.3461    1.2944 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5725    1.1797   -0.3155 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4316   -0.1907   -0.7669 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7537   -0.2154    1.7214 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8915    1.1727    1.9885 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6774    2.6252    0.5234 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4782    1.8924    1.7499 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2220    0.8566   -1.1426 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4574    1.9483   -0.5227 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0377    0.1431    1.2423 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7318   -0.8756    0.6071 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8334   -0.9336   -1.6197 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8316   -1.5630   -0.2063 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1297   -0.0584   -1.8696 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0022    1.2489   -1.5443 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6103    1.3410    0.8226 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9705    1.5879   -0.2794 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3306   -0.9341    1.4098 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7208   -1.0593   -1.0878 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8621    0.8385   -0.4193 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1794   -1.5484    1.0414 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0665   -0.0084    0.5235 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0539   -0.7637   -1.6540 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4893   -0.5407    2.3467 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5049    2.1320    1.4274 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  5  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 19 22  1  0
 22 23  1  0
 22 17  1  0
  1 24  1  0
  1 25  1  0
  1 26  1  0
  2 27  1  0
  3 28  1  0
  3 29  1  0
  3 30  1  0
  4 31  1  0
  4 32  1  0
  5 33  1  6
  6 34  1  0
  7 35  1  0
  7 36  1  0
  8 37  1  0
  8 38  1  0
  9 39  1  0
  9 40  1  0
 10 41  1  0
 10 42  1  0
 11 43  1  0
 11 44  1  0
 12 45  1  0
 12 46  1  0
 13 47  1  0
 13 48  1  0
 14 49  1  0
 14 50  1  0
 15 51  1  0
 15 52  1  0
 16 53  1  0
 16 54  1  0
 17 55  1  1
 18 56  1  0
 19 57  1  6
 20 58  1  0
 20 59  1  0
 21 60  1  0
 22 61  1  1
 23 62  1  0
M  END

  Mrv1652309082208332D          

 23 23  0  0  1  0            999 V2000
    8.9754   -3.2149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6899   -2.8024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6899   -1.9774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4043   -3.2149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1188   -2.8024    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.1188   -1.9774    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8333   -3.2149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5478   -2.8024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2622   -3.2149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9767   -2.8024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6912   -3.2149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4056   -2.8024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1201   -3.2149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8346   -2.8024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5491   -3.2149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2635   -2.8024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.9780   -3.2149    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   19.7749   -3.0014    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   19.9884   -3.7983    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   20.7029   -4.2108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.4174   -3.7983    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.1915   -4.0118    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   18.7790   -4.7262    0.0000 O   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
  2  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  1  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  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  1  0  0  0  0
 15 16  1  0  0  0  0
 17 16  1  6  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  1  0  0  0
 20 21  1  0  0  0  0
 19 22  1  0  0  0  0
 17 22  1  0  0  0  0
 22 23  1  6  0  0  0
M  END
> <DATABASE_ID>
NP0263386

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CC(C)C[C@@H](O)CCCCCCCCCC[C@@H]1N[C@@H](CO)[C@@H]1O

> <INCHI_IDENTIFIER>
InChI=1S/C19H39NO3/c1-15(2)13-16(22)11-9-7-5-3-4-6-8-10-12-17-19(23)18(14-21)20-17/h15-23H,3-14H2,1-2H3/t16-,17-,18-,19+/m0/s1

> <INCHI_KEY>
GOJDAUFFWJKIPB-CADBVGFASA-N

> <FORMULA>
C19H39NO3

> <MOLECULAR_WEIGHT>
329.525

> <EXACT_MASS>
329.29299412

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_ATOM_COUNT>
62

> <JCHEM_AVERAGE_POLARIZABILITY>
42.289503301882036

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
4

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
(2S,3R,4S)-2-[(11S)-11-hydroxy-13-methyltetradecyl]-4-(hydroxymethyl)azetidin-3-ol

> <JCHEM_LOGP>
3.5491486699999997

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
1

> <JCHEM_PKA>
15.179323217759446

> <JCHEM_PKA_STRONGEST_ACIDIC>
14.029421507077714

> <JCHEM_PKA_STRONGEST_BASIC>
8.596024883702176

> <JCHEM_POLAR_SURFACE_AREA>
72.72

> <JCHEM_REFRACTIVITY>
95.02229999999996

> <JCHEM_ROTATABLE_BOND_COUNT>
14

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
penaresidin B

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 08-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   08-SEP-22         0                                  
HETATM    1  C   UNK     0      16.754  -6.001   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      18.088  -5.231   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      18.088  -3.691   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      19.421  -6.001   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      20.755  -5.231   0.000  0.00  0.00           C+0
HETATM    6  O   UNK     0      20.755  -3.691   0.000  0.00  0.00           O+0
HETATM    7  C   UNK     0      22.089  -6.001   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      23.422  -5.231   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      24.756  -6.001   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      26.090  -5.231   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      27.424  -6.001   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      28.757  -5.231   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      30.091  -6.001   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      31.425  -5.231   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      32.758  -6.001   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      34.092  -5.231   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      35.426  -6.001   0.000  0.00  0.00           C+0
HETATM   18  N   UNK     0      36.913  -5.603   0.000  0.00  0.00           N+0
HETATM   19  C   UNK     0      37.312  -7.090   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      38.645  -7.860   0.000  0.00  0.00           C+0
HETATM   21  O   UNK     0      39.979  -7.090   0.000  0.00  0.00           O+0
HETATM   22  C   UNK     0      35.824  -7.489   0.000  0.00  0.00           C+0
HETATM   23  O   UNK     0      35.054  -8.822   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3    4                                                  
CONECT    3    2                                                            
CONECT    4    2    5                                                       
CONECT    5    4    6    7                                                  
CONECT    6    5                                                            
CONECT    7    5    8                                                       
CONECT    8    7    9                                                       
CONECT    9    8   10                                                       
CONECT   10    9   11                                                       
CONECT   11   10   12                                                       
CONECT   12   11   13                                                       
CONECT   13   12   14                                                       
CONECT   14   13   15                                                       
CONECT   15   14   16                                                       
CONECT   16   15   17                                                       
CONECT   17   16   18   22                                                  
CONECT   18   17   19                                                       
CONECT   19   18   20   22                                                  
CONECT   20   19   21                                                       
CONECT   21   20                                                            
CONECT   22   19   17   23                                                  
CONECT   23   22                                                            
MASTER        0    0    0    0    0    0    0    0   23    0   46    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₁₉H₃₉NO₃

Average Mass

329.5250 Da

Monoisotopic Mass

329.29299 Da

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

CC(C)C[C@@H](O)CCCCCCCCCC[C@@H]1N[C@@H](CO)[C@@H]1O

InChI Identifier

InChI=1S/C19H39NO3/c1-15(2)13-16(22)11-9-7-5-3-4-6-8-10-12-17-19(23)18(14-21)20-17/h15-23H,3-14H2,1-2H3/t16-,17-,18-,19+/m0/s1

InChI Key

GOJDAUFFWJKIPB-CADBVGFASA-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 azetidines. These are organic compounds containing a saturated four-member heterocycle where one nitrogen atom replaces a carbon atom.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Azetidines

Sub Class

Not Available

Direct Parent

Azetidines

Alternative Parents

Substituents

Secondary alcohol
Azetidine
1,2-aminoalcohol
Azacycle
Secondary amine
Secondary aliphatic amine
Organic nitrogen compound
Organic oxygen compound
Hydrocarbon derivative
Primary alcohol
Organooxygen compound
Organonitrogen compound
Amine
Alcohol
Aliphatic heteromonocyclic compound

Molecular Framework

Aliphatic heteromonocyclic compounds

External Descriptors

Sphingoid base analogs (LMSP01080046 )

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

9177210

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

11002018

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Betz KN, Chiappini ND, Du Bois J: Intermolecular sp(3)-C-H Amination for the Synthesis of Saturated Azacycles. Org Lett. 2020 Mar 6;22(5):1687-1691. doi: 10.1021/acs.orglett.9b04096. Epub 2019 Dec 24. [PubMed:31873026 ]
Ding F, William R, Kock SM, Leow ML, Liu XW: A concise route to the highly-functionalized azetidine precursor: the enantioselective synthesis of penaresidin B. Chem Commun (Camb). 2015 Mar 18;51(22):4639-42. doi: 10.1039/c4cc09904d. [PubMed:25692188 ]
Ohshita K, Ishiyama H, Takahashi Y, Ito J, Mikami Y, Kobayashi J: Synthesis of penaresidin derivatives and its biological activity. Bioorg Med Chem. 2007 Jul 15;15(14):4910-6. doi: 10.1016/j.bmc.2007.04.049. Epub 2007 Apr 29. [PubMed:17509887 ]
LOTUS database [Link]

Showing NP-Card for penaresidin b (NP0263386)

MOL for NP0263386 (penaresidin b)

3D MOL for NP0263386 (penaresidin b)

3D SDF for NP0263386 (penaresidin b)

3D-SDF for NP0263386 (penaresidin b)

PDB for NP0263386 (penaresidin b)

3D PDB for NP0263386 (penaresidin b)

SMILES for NP0263386 (penaresidin b)

INCHI for NP0263386 (penaresidin b)

Structure for NP0263386 (penaresidin b)

3D Structure for NP0263386 (penaresidin b)