NP-MRD: Showing NP-Card for 2-(4-{2-carboxy-2-[4-(2-carboxyeth-1-en-1-yl)-2-methoxyphenoxy]eth-1-en-1-yl}-2-methoxyphenoxy)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid (NP0242488)

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Record Information

Version

2.0

Created at

2022-09-07 02:48:51 UTC

Updated at

2022-09-07 02:48:51 UTC

NP-MRD ID

NP0242488

Secondary Accession Numbers

None

Natural Product Identification

Common Name

2-(4-{2-carboxy-2-[4-(2-carboxyeth-1-en-1-yl)-2-methoxyphenoxy]eth-1-en-1-yl}-2-methoxyphenoxy)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid

Description

3-(4-{[1-Carboxy-2-(4-hydroxy-3-methoxyphenyl)eth-1-en-1-yl]oxy}-3-methoxyphenyl)-2-[4-(2-carboxyeth-1-en-1-yl)-2-methoxyphenoxy]prop-2-enoic acid belongs to the class of organic compounds known as phenylpyruvic acid derivatives. Phenylpyruvic acid derivatives are compounds containing a phenylpyruvic acid moiety, which consists of a phenyl group substituted at the second position by an pyruvic acid. 2-(4-{2-carboxy-2-[4-(2-carboxyeth-1-en-1-yl)-2-methoxyphenoxy]eth-1-en-1-yl}-2-methoxyphenoxy)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid is found in Centella asiatica and Fatsia japonica. 3-(4-{[1-Carboxy-2-(4-hydroxy-3-methoxyphenyl)eth-1-en-1-yl]oxy}-3-methoxyphenyl)-2-[4-(2-carboxyeth-1-en-1-yl)-2-methoxyphenoxy]prop-2-enoic acid is an extremely weak basic (essentially neutral) compound (based on its pKa).

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1533004231515372D          

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M  END

     RDKit          3D

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M  END


  Mrv1533004231515372D          

 42 44  0  0  0  0            999 V2000
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   -5.7158   -7.4250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7158   -6.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8579   -6.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434   -6.1875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8579   -7.4250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0013   -5.3625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7158   -4.9500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7158   -4.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4302   -3.7125    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
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  6  5  1  4  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 13 12  1  4  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 20 19  1  4  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 22 24  1  0  0  0  0
 19 25  1  0  0  0  0
 25 26  2  0  0  0  0
 16 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 14 29  1  0  0  0  0
 29 30  2  0  0  0  0
 29 31  1  0  0  0  0
 12 32  1  0  0  0  0
 32 33  2  0  0  0  0
  9 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
  7 36  1  0  0  0  0
 36 37  2  0  0  0  0
 36 38  1  0  0  0  0
  5 39  2  0  0  0  0
 39 40  1  0  0  0  0
 40 41  2  0  0  0  0
  3 41  1  0  0  0  0
 41 42  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0242488

> <DATABASE_NAME>
NP-MRD

> <SMILES>
COC1=CC(C=C(OC2=CC=C(C=C(OC3=CC=C(C=CC(O)=O)C=C3OC)C(O)=O)C=C2OC)C(O)=O)=CC=C1O

> <INCHI_IDENTIFIER>
InChI=1S/C30H26O12/c1-38-23-13-18(4-8-20(23)31)15-26(29(34)35)42-22-10-6-19(14-25(22)40-3)16-27(30(36)37)41-21-9-5-17(7-11-28(32)33)12-24(21)39-2/h4-16,31H,1-3H3,(H,32,33)(H,34,35)(H,36,37)

> <INCHI_KEY>
UWXGIJKBCAIMFK-UHFFFAOYSA-N

> <FORMULA>
C30H26O12

> <MOLECULAR_WEIGHT>
578.526

> <EXACT_MASS>
578.142426277

> <JCHEM_ACCEPTOR_COUNT>
12

> <JCHEM_ATOM_COUNT>
68

> <JCHEM_AVERAGE_POLARIZABILITY>
57.216714563810044

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
4

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
2-(4-{2-carboxy-2-[4-(2-carboxyeth-1-en-1-yl)-2-methoxyphenoxy]eth-1-en-1-yl}-2-methoxyphenoxy)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid

> <ALOGPS_LOGP>
3.97

> <JCHEM_LOGP>
4.255577676

> <ALOGPS_LOGS>
-5.51

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-3

> <JCHEM_PKA>
3.3538370878238686

> <JCHEM_PKA_STRONGEST_ACIDIC>
2.783830847323597

> <JCHEM_PKA_STRONGEST_BASIC>
-4.378100988631673

> <JCHEM_POLAR_SURFACE_AREA>
178.28

> <JCHEM_REFRACTIVITY>
150.8888

> <JCHEM_ROTATABLE_BOND_COUNT>
13

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.80e-03 g/l

> <JCHEM_TRADITIONAL_IUPAC>
2-(4-{2-carboxy-2-[4-(2-carboxyeth-1-en-1-yl)-2-methoxyphenoxy]eth-1-en-1-yl}-2-methoxyphenoxy)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 23-APR-15   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   23-APR-15         0                                  
HETATM    1  C   UNK     0     -10.669  -4.620   0.000  0.00  0.00           C+0
HETATM    2  O   UNK     0      -9.336  -5.390   0.000  0.00  0.00           O+0
HETATM    3  C   UNK     0      -9.336  -6.930   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -8.002  -7.700   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      -8.002  -9.240   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -6.668 -10.010   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      -6.668 -11.550   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0      -8.002 -12.320   0.000  0.00  0.00           O+0
HETATM    9  C   UNK     0      -8.002 -13.860   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      -6.668 -14.630   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -6.668 -16.170   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      -8.002 -16.940   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      -8.002 -18.480   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      -9.336 -19.250   0.000  0.00  0.00           C+0
HETATM   15  O   UNK     0      -9.336 -20.790   0.000  0.00  0.00           O+0
HETATM   16  C   UNK     0      -8.002 -21.560   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      -6.668 -20.790   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      -5.335 -21.560   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      -5.335 -23.100   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      -4.001 -23.870   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      -4.001 -25.410   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      -5.335 -26.180   0.000  0.00  0.00           C+0
HETATM   23  O   UNK     0      -5.335 -27.720   0.000  0.00  0.00           O+0
HETATM   24  O   UNK     0      -6.668 -25.410   0.000  0.00  0.00           O+0
HETATM   25  C   UNK     0      -6.668 -23.870   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0      -8.002 -23.100   0.000  0.00  0.00           C+0
HETATM   27  O   UNK     0      -9.336 -23.870   0.000  0.00  0.00           O+0
HETATM   28  C   UNK     0     -10.669 -23.100   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0     -10.669 -18.480   0.000  0.00  0.00           C+0
HETATM   30  O   UNK     0     -12.003 -19.250   0.000  0.00  0.00           O+0
HETATM   31  O   UNK     0     -10.669 -16.940   0.000  0.00  0.00           O+0
HETATM   32  C   UNK     0      -9.336 -16.170   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0      -9.336 -14.630   0.000  0.00  0.00           C+0
HETATM   34  O   UNK     0     -10.669 -13.860   0.000  0.00  0.00           O+0
HETATM   35  C   UNK     0     -10.669 -12.320   0.000  0.00  0.00           C+0
HETATM   36  C   UNK     0      -5.335 -12.320   0.000  0.00  0.00           C+0
HETATM   37  O   UNK     0      -4.001 -11.550   0.000  0.00  0.00           O+0
HETATM   38  O   UNK     0      -5.335 -13.860   0.000  0.00  0.00           O+0
HETATM   39  C   UNK     0      -9.336 -10.010   0.000  0.00  0.00           C+0
HETATM   40  C   UNK     0     -10.669  -9.240   0.000  0.00  0.00           C+0
HETATM   41  C   UNK     0     -10.669  -7.700   0.000  0.00  0.00           C+0
HETATM   42  O   UNK     0     -12.003  -6.930   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3                                                       
CONECT    3    2    4   41                                                  
CONECT    4    3    5                                                       
CONECT    5    4    6   39                                                  
CONECT    6    5    7                                                       
CONECT    7    6    8   36                                                  
CONECT    8    7    9                                                       
CONECT    9    8   10   33                                                  
CONECT   10    9   11                                                       
CONECT   11   10   12                                                       
CONECT   12   11   13   32                                                  
CONECT   13   12   14                                                       
CONECT   14   13   15   29                                                  
CONECT   15   14   16                                                       
CONECT   16   15   17   26                                                  
CONECT   17   16   18                                                       
CONECT   18   17   19                                                       
CONECT   19   18   20   25                                                  
CONECT   20   19   21                                                       
CONECT   21   20   22                                                       
CONECT   22   21   23   24                                                  
CONECT   23   22                                                            
CONECT   24   22                                                            
CONECT   25   19   26                                                       
CONECT   26   25   16   27                                                  
CONECT   27   26   28                                                       
CONECT   28   27                                                            
CONECT   29   14   30   31                                                  
CONECT   30   29                                                            
CONECT   31   29                                                            
CONECT   32   12   33                                                       
CONECT   33   32    9   34                                                  
CONECT   34   33   35                                                       
CONECT   35   34                                                            
CONECT   36    7   37   38                                                  
CONECT   37   36                                                            
CONECT   38   36                                                            
CONECT   39    5   40                                                       
CONECT   40   39   41                                                       
CONECT   41   40    3   42                                                  
CONECT   42   41                                                            
MASTER        0    0    0    0    0    0    0    0   42    0   88    0
END

View in JSmol

Synonyms

Value	Source
3-(4-{[1-carboxy-2-(4-hydroxy-3-methoxyphenyl)eth-1-en-1-yl]oxy}-3-methoxyphenyl)-2-[4-(2-carboxyeth-1-en-1-yl)-2-methoxyphenoxy]prop-2-enoate	Generator

Chemical Formula

C₃₀H₂₆O₁₂

Average Mass

578.5260 Da

Monoisotopic Mass

578.14243 Da

IUPAC Name

2-(4-{2-carboxy-2-[4-(2-carboxyeth-1-en-1-yl)-2-methoxyphenoxy]eth-1-en-1-yl}-2-methoxyphenoxy)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid

Traditional Name

2-(4-{2-carboxy-2-[4-(2-carboxyeth-1-en-1-yl)-2-methoxyphenoxy]eth-1-en-1-yl}-2-methoxyphenoxy)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid

CAS Registry Number

Not Available

SMILES

COC1=CC(C=C(OC2=CC=C(C=C(OC3=CC=C(C=CC(O)=O)C=C3OC)C(O)=O)C=C2OC)C(O)=O)=CC=C1O

InChI Identifier

InChI=1S/C30H26O12/c1-38-23-13-18(4-8-20(23)31)15-26(29(34)35)42-22-10-6-19(14-25(22)40-3)16-27(30(36)37)41-21-9-5-17(7-11-28(32)33)12-24(21)39-2/h4-16,31H,1-3H3,(H,32,33)(H,34,35)(H,36,37)

InChI Key

UWXGIJKBCAIMFK-UHFFFAOYSA-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
Centella asiatica	LOTUS Database	35616633
Fatsia japonica	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as phenylpyruvic acid derivatives. Phenylpyruvic acid derivatives are compounds containing a phenylpyruvic acid moiety, which consists of a phenyl group substituted at the second position by an pyruvic acid.

Kingdom

Organic compounds

Super Class

Benzenoids

Class

Benzene and substituted derivatives

Sub Class

Phenylpyruvic acid derivatives

Direct Parent

Phenylpyruvic acid derivatives

Alternative Parents

Substituents

Cinnamic acid
Cinnamic acid or derivatives
Coumaric acid or derivatives
Hydroxycinnamic acid
Hydroxycinnamic acid or derivatives
Enol-phenylpyruvate
Phenoxyacetate
Methoxyphenol
Tricarboxylic acid or derivatives
Phenol ether
Styrene
Methoxybenzene
Anisole
Phenoxy compound
Alkyl aryl ether
Phenol
1-hydroxy-2-unsubstituted benzenoid
Carboxylic acid derivative
Carboxylic acid
Ether
Hydrocarbon derivative
Organooxygen compound
Carbonyl group
Organic oxide
Organic oxygen compound
Aromatic homomonocyclic compound

Molecular Framework

Aromatic homomonocyclic 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	3.97	ALOGPS
logP	4.26	ChemAxon
logS	-5.5	ALOGPS
pKa (Strongest Acidic)	2.78	ChemAxon
pKa (Strongest Basic)	-4.4	ChemAxon
Physiological Charge	-3	ChemAxon
Hydrogen Acceptor Count	12	ChemAxon
Hydrogen Donor Count	4	ChemAxon
Polar Surface Area	178.28 Å²	ChemAxon
Rotatable Bond Count	13	ChemAxon
Refractivity	150.89 m³·mol⁻¹	ChemAxon
Polarizability	57.22 Å³	ChemAxon
Number of Rings	3	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

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

73804523

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

LOTUS database [Link]

Showing NP-Card for 2-(4-{2-carboxy-2-[4-(2-carboxyeth-1-en-1-yl)-2-methoxyphenoxy]eth-1-en-1-yl}-2-methoxyphenoxy)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid (NP0242488)

MOL for NP0242488 (2-(4-{2-carboxy-2-[4-(2-carboxyeth-1-en-1-yl)-2-methoxyphenoxy]eth-1-en-1-yl}-2-methoxyphenoxy)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid)

3D MOL for NP0242488 (2-(4-{2-carboxy-2-[4-(2-carboxyeth-1-en-1-yl)-2-methoxyphenoxy]eth-1-en-1-yl}-2-methoxyphenoxy)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid)

3D SDF for NP0242488 (2-(4-{2-carboxy-2-[4-(2-carboxyeth-1-en-1-yl)-2-methoxyphenoxy]eth-1-en-1-yl}-2-methoxyphenoxy)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid)

3D-SDF for NP0242488 (2-(4-{2-carboxy-2-[4-(2-carboxyeth-1-en-1-yl)-2-methoxyphenoxy]eth-1-en-1-yl}-2-methoxyphenoxy)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid)

PDB for NP0242488 (2-(4-{2-carboxy-2-[4-(2-carboxyeth-1-en-1-yl)-2-methoxyphenoxy]eth-1-en-1-yl}-2-methoxyphenoxy)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid)

3D PDB for NP0242488 (2-(4-{2-carboxy-2-[4-(2-carboxyeth-1-en-1-yl)-2-methoxyphenoxy]eth-1-en-1-yl}-2-methoxyphenoxy)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid)

SMILES for NP0242488 (2-(4-{2-carboxy-2-[4-(2-carboxyeth-1-en-1-yl)-2-methoxyphenoxy]eth-1-en-1-yl}-2-methoxyphenoxy)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid)

INCHI for NP0242488 (2-(4-{2-carboxy-2-[4-(2-carboxyeth-1-en-1-yl)-2-methoxyphenoxy]eth-1-en-1-yl}-2-methoxyphenoxy)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid)

Structure for NP0242488 (2-(4-{2-carboxy-2-[4-(2-carboxyeth-1-en-1-yl)-2-methoxyphenoxy]eth-1-en-1-yl}-2-methoxyphenoxy)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid)

3D Structure for NP0242488 (2-(4-{2-carboxy-2-[4-(2-carboxyeth-1-en-1-yl)-2-methoxyphenoxy]eth-1-en-1-yl}-2-methoxyphenoxy)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid)