NP-MRD: Showing NP-Card for luzonidial b (NP0322606)

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Record Information

Version

2.0

Created at

2022-09-12 01:28:16 UTC

Updated at

2022-09-12 01:28:16 UTC

NP-MRD ID

NP0322606

Secondary Accession Numbers

None

Natural Product Identification

Common Name

luzonidial b

Description

Luzonidial B belongs to the class of organic compounds known as coumaric acid esters. These are aromatic compounds containing an ester derivative of coumaric acid. Luzonidial B is a secondary metabolite. Secondary metabolites are metabolically or physiologically non-essential metabolites that may serve a role as defense or signalling molecules. In some cases they are simply molecules that arise from the incomplete metabolism of other secondary metabolites. luzonidial b is found in Viburnum luzonicum. luzonidial b was first documented in 2005 (PMID: 15635247). Based on a literature review very few articles have been published on luzonidial B.

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 43 44  0  0  0  0  0  0  0  0999 V2000
    5.3270    1.4102    1.2969 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1707    1.1564    0.6687 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5327    2.2353   -0.0573 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0949    3.3832   -0.0674 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6298   -0.2066    0.7541 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.2883   -0.3263    1.3903 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3130   -0.3551    0.2845 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.2631   -1.2906    0.4719 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0935   -0.8923    0.3077 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1929    0.3024    0.0007 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1297   -1.8834    0.5102 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4039   -1.6732    0.4542 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0745   -0.4243    0.2042 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2599   -0.4840   -0.5494 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0611    0.6060   -0.7694 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7417    1.8402   -0.2540 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5321    2.9650   -0.4605 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5890    1.9179    0.4865 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7624    0.7947    0.7157 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1288   -0.8802   -0.8876 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4556   -1.3878   -2.1025 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2268   -1.8436   -3.1106 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4072   -0.8004   -0.6258 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5600   -1.1788   -1.4311 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5740   -1.6696   -2.5653 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7767    2.3970    1.2705 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8558    0.6599    1.8483 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6221    2.1814   -0.6004 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3912   -0.8586    1.2761 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1101    0.4889    2.1324 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2995   -1.3117    1.9537 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9504    0.6363    0.0169 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8320   -2.9379    0.7378 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0461   -2.5910    0.6242 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5342   -1.4447   -0.9667 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9700    0.5446   -1.3525 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4147    3.5960   -1.2404 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2899    2.8672    0.9164 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9139    0.9364    1.3796 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7172   -0.6069   -2.4292 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7903   -2.2556   -1.7787 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8072   -2.6021   -3.5803 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5494   -1.0141   -0.9905 H   0  0  0  0  0  0  0  0  0  0  0  0
 22 21  1  0
 21 20  1  0
 20 23  2  0
 23 24  1  0
 24 25  2  0
 23  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  2  0
  9 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  2  0
 16 17  1  0
 16 18  1  0
 18 19  2  0
  5  2  1  0
  2  1  2  3
  2  3  1  0
  3  4  2  0
  7 20  1  0
 19 13  1  0
 22 42  1  0
 21 40  1  0
 21 41  1  0
 24 43  1  0
  5 29  1  1
  6 30  1  0
  6 31  1  0
  7 32  1  6
 11 33  1  0
 12 34  1  0
 14 35  1  0
 15 36  1  0
 17 37  1  0
 18 38  1  0
 19 39  1  0
  1 26  1  0
  1 27  1  0
  3 28  1  0
M  END


  Mrv1652309122203282D          

 25 26  0  0  1  0            999 V2000
    4.8946    1.0527    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1801    0.6402    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4656    1.0527    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4656    1.8777    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1801   -0.1848    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.8476   -0.6697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5926   -1.4544    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.0775   -2.1218    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7420   -2.8755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9215   -2.9617    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2269   -3.5429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8914   -4.2966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0709   -4.3828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7353   -5.1365    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9148   -5.2227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4299   -4.5553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6094   -4.6415    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7655   -3.8016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5859   -3.7154    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7676   -1.4544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2827   -2.1218    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4622   -2.0356    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5127   -0.6697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7281   -0.4148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5565    0.3922    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  5  2  1  1  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  6  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  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
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 16 18  1  0  0  0  0
 18 19  2  0  0  0  0
 13 19  1  0  0  0  0
  7 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 20 23  2  0  0  0  0
  5 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
M  END
> <DATABASE_ID>
NP0322606

> <DATABASE_NAME>
NP-MRD

> <SMILES>
OCC1=C(C=O)[C@H](C[C@@H]1OC(=O)\C=C/C1=CC=C(O)C=C1)C(=C)C=O

> <INCHI_IDENTIFIER>
InChI=1S/C19H18O6/c1-12(9-20)15-8-18(17(11-22)16(15)10-21)25-19(24)7-4-13-2-5-14(23)6-3-13/h2-7,9-10,15,18,22-23H,1,8,11H2/b7-4-/t15-,18+/m1/s1

> <INCHI_KEY>
IOKUHHOVWITKLG-DYKRAQSHSA-N

> <FORMULA>
C19H18O6

> <MOLECULAR_WEIGHT>
342.347

> <EXACT_MASS>
342.1103383

> <JCHEM_ACCEPTOR_COUNT>
5

> <JCHEM_ATOM_COUNT>
43

> <JCHEM_AVERAGE_POLARIZABILITY>
33.606414967754894

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
2

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
(1S,4R)-3-formyl-2-(hydroxymethyl)-4-(3-oxoprop-1-en-2-yl)cyclopent-2-en-1-yl (2Z)-3-(4-hydroxyphenyl)prop-2-enoate

> <JCHEM_LOGP>
1.3035011243333332

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
2

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
15.025475703213566

> <JCHEM_PKA_STRONGEST_ACIDIC>
9.398564580988868

> <JCHEM_PKA_STRONGEST_BASIC>
-2.7876573759051517

> <JCHEM_POLAR_SURFACE_AREA>
100.9

> <JCHEM_REFRACTIVITY>
92.5837

> <JCHEM_ROTATABLE_BOND_COUNT>
8

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
(1S,4R)-3-formyl-2-(hydroxymethyl)-4-(3-oxoprop-1-en-2-yl)cyclopent-2-en-1-yl (2Z)-3-(4-hydroxyphenyl)prop-2-enoate

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 12-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   12-SEP-22         0                                  
HETATM    1  C   UNK     0       9.137   1.965   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       7.803   1.195   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       6.469   1.965   0.000  0.00  0.00           C+0
HETATM    4  O   UNK     0       6.469   3.505   0.000  0.00  0.00           O+0
HETATM    5  C   UNK     0       7.803  -0.345   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       9.049  -1.250   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       8.573  -2.715   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0       9.478  -3.961   0.000  0.00  0.00           O+0
HETATM    9  C   UNK     0       8.852  -5.368   0.000  0.00  0.00           C+0
HETATM   10  O   UNK     0       7.320  -5.529   0.000  0.00  0.00           O+0
HETATM   11  C   UNK     0       9.757  -6.613   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       9.131  -8.020   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       7.599  -8.181   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       6.973  -9.588   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       5.441  -9.749   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       4.536  -8.503   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0       3.004  -8.664   0.000  0.00  0.00           O+0
HETATM   18  C   UNK     0       5.162  -7.096   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       6.694  -6.935   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       7.033  -2.715   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       6.128  -3.961   0.000  0.00  0.00           C+0
HETATM   22  O   UNK     0       4.596  -3.800   0.000  0.00  0.00           O+0
HETATM   23  C   UNK     0       6.557  -1.250   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0       5.092  -0.774   0.000  0.00  0.00           C+0
HETATM   25  O   UNK     0       4.772   0.732   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3    5                                                  
CONECT    3    2    4                                                       
CONECT    4    3                                                            
CONECT    5    2    6   23                                                  
CONECT    6    5    7                                                       
CONECT    7    6    8   20                                                  
CONECT    8    7    9                                                       
CONECT    9    8   10   11                                                  
CONECT   10    9                                                            
CONECT   11    9   12                                                       
CONECT   12   11   13                                                       
CONECT   13   12   14   19                                                  
CONECT   14   13   15                                                       
CONECT   15   14   16                                                       
CONECT   16   15   17   18                                                  
CONECT   17   16                                                            
CONECT   18   16   19                                                       
CONECT   19   18   13                                                       
CONECT   20    7   21   23                                                  
CONECT   21   20   22                                                       
CONECT   22   21                                                            
CONECT   23   20    5   24                                                  
CONECT   24   23   25                                                       
CONECT   25   24                                                            
MASTER        0    0    0    0    0    0    0    0   25    0   52    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₁₉H₁₈O₆

Average Mass

342.3470 Da

Monoisotopic Mass

342.11034 Da

IUPAC Name

(1S,4R)-3-formyl-2-(hydroxymethyl)-4-(3-oxoprop-1-en-2-yl)cyclopent-2-en-1-yl (2Z)-3-(4-hydroxyphenyl)prop-2-enoate

Traditional Name

(1S,4R)-3-formyl-2-(hydroxymethyl)-4-(3-oxoprop-1-en-2-yl)cyclopent-2-en-1-yl (2Z)-3-(4-hydroxyphenyl)prop-2-enoate

CAS Registry Number

Not Available

SMILES

OCC1=C(C=O)[C@H](C[C@@H]1OC(=O)\C=C/C1=CC=C(O)C=C1)C(=C)C=O

InChI Identifier

InChI=1S/C19H18O6/c1-12(9-20)15-8-18(17(11-22)16(15)10-21)25-19(24)7-4-13-2-5-14(23)6-3-13/h2-7,9-10,15,18,22-23H,1,8,11H2/b7-4-/t15-,18+/m1/s1

InChI Key

IOKUHHOVWITKLG-DYKRAQSHSA-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

Species Name	Source	Reference
Viburnum luzonicum	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as coumaric acid esters. These are aromatic compounds containing an ester derivative of coumaric acid.

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Cinnamic acids and derivatives

Sub Class

Hydroxycinnamic acids and derivatives

Direct Parent

Coumaric acid esters

Alternative Parents

Substituents

Coumaric acid ester
Coumaric acid or derivatives
Cinnamic acid ester
Aromatic monoterpenoid
Monocyclic monoterpenoid
Monoterpenoid
Styrene
1-hydroxy-2-unsubstituted benzenoid
Fatty acid ester
Phenol
Monocyclic benzene moiety
Fatty acyl
Benzenoid
Alpha,beta-unsaturated aldehyde
Alpha,beta-unsaturated carboxylic ester
Enal
Enoate ester
Carboxylic acid ester
Carboxylic acid derivative
Monocarboxylic acid or derivatives
Alcohol
Aldehyde
Hydrocarbon derivative
Carbonyl group
Organic oxide
Organic oxygen compound
Primary alcohol
Organooxygen compound
Aromatic homomonocyclic compound

Molecular Framework

Aromatic homomonocyclic compounds

External Descriptors

phenols (CHEBI:66600 )
cinnamate ester (CHEBI:66600 )
aldehyde (CHEBI:66600 )
iridoid monoterpenoid (CHEBI:66600 )

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	1.3	ChemAxon
pKa (Strongest Acidic)	9.4	ChemAxon
pKa (Strongest Basic)	-2.8	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	5	ChemAxon
Hydrogen Donor Count	2	ChemAxon
Polar Surface Area	100.9 Å²	ChemAxon
Rotatable Bond Count	8	ChemAxon
Refractivity	92.58 m³·mol⁻¹	ChemAxon
Polarizability	33.61 Å³	ChemAxon
Number of Rings	2	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	Yes	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

External Links

HMDB ID

Not Available

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

Not Available

KNApSAcK ID

C00051354

Chemspider ID

7827834

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

9548911

PDB ID

Not Available

ChEBI ID

66600

Good Scents ID

Not Available

References

General References

Fukuyama Y, Minoshima Y, Kishimoto Y, Chen IS, Takahashi H, Esumi T: Cytotoxic iridoid aldehydes from Taiwanese Viburnum luzonicum. Chem Pharm Bull (Tokyo). 2005 Jan;53(1):125-7. doi: 10.1248/cpb.53.125. [PubMed:15635247 ]
LOTUS database [Link]

Showing NP-Card for luzonidial b (NP0322606)

MOL for NP0322606 (luzonidial b)

3D MOL for NP0322606 (luzonidial b)

3D SDF for NP0322606 (luzonidial b)

3D-SDF for NP0322606 (luzonidial b)

PDB for NP0322606 (luzonidial b)

3D PDB for NP0322606 (luzonidial b)

SMILES for NP0322606 (luzonidial b)

INCHI for NP0322606 (luzonidial b)

Structure for NP0322606 (luzonidial b)

3D Structure for NP0322606 (luzonidial b)