NP-MRD: Showing NP-Card for 5-chloro-2-[2-(2-hydroxyethoxy)ethyl]-6a-methyl-3-(3-methylpent-1-en-1-yl)-9-propanoylfuro[2,3-h]isoquinoline-6,8-dione (NP0207820)

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Record Information

Version

2.0

Created at

2022-09-05 04:35:22 UTC

Updated at

2022-09-05 04:35:22 UTC

NP-MRD ID

NP0207820

Secondary Accession Numbers

None

Natural Product Identification

Common Name

5-chloro-2-[2-(2-hydroxyethoxy)ethyl]-6a-methyl-3-(3-methylpent-1-en-1-yl)-9-propanoylfuro[2,3-h]isoquinoline-6,8-dione

Description

5-Chloro-2-[2-(2-hydroxyethoxy)ethyl]-6a-methyl-3-(3-methylpent-1-en-1-yl)-9-propanoyl-2H,6H,6aH,8H-furo[2,3-h]isoquinoline-6,8-dione belongs to the class of organic compounds known as isoquinolones and derivatives. These are aromatic polycyclic compounds containing a ketone bearing isoquinoline moiety. Based on a literature review very few articles have been published on 5-chloro-2-[2-(2-hydroxyethoxy)ethyl]-6a-methyl-3-(3-methylpent-1-en-1-yl)-9-propanoyl-2H,6H,6aH,8H-furo[2,3-h]isoquinoline-6,8-dione.

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1652309052206352D          

 33 35  0  0  0  0            999 V2000
    0.6357    4.5346    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1713    4.7061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7233    4.0930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4684    3.3084    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5303    4.2645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434    3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434    2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    1.6500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0000    1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8579    1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8579    2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5724    2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2868    2.4750    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.5724    3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2868    4.1250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.6864    4.9320    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8659    5.0182    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4534    5.7327    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  3  5  1  0  0  0  0
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  9 10  1  0  0  0  0
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 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
  9 16  1  0  0  0  0
 17 16  1  4  0  0  0
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 32 33  2  0  0  0  0
M  END

     RDKit          3D

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    0.9320    1.3082    1.6459 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5183    0.9043    5.6252 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7648   -0.5997   -1.2015 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1811   -0.8672   -1.2755 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1630   -0.8016   -0.4721 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5873   -1.1768   -0.8786 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.6693   -1.6214   -2.2893 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0382   -2.2454    0.0872 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4549   -2.6541   -0.1444 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0518   -0.7494   -2.3538 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3742   -0.5112   -2.4322 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1203   -0.7013   -3.5055 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3489   -1.2715   -4.9605 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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    5.2233   -0.2811   -0.7300 H   0  0  0  0  0  0  0  0  0  0  0  0
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M  END


  Mrv1652309052206352D          

 33 35  0  0  0  0            999 V2000
    0.6357    4.5346    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1713    4.7061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7233    4.0930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4684    3.3084    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5303    4.2645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
> <DATABASE_ID>
NP0207820

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CCC(C)C=CC1=CC2=C(Cl)C(=O)C3(C)OC(=O)C(C(=O)CC)=C3C2=CN1CCOCCO

> <INCHI_IDENTIFIER>
InChI=1S/C25H30ClNO6/c1-5-15(3)7-8-16-13-17-18(14-27(16)9-11-32-12-10-28)21-20(19(29)6-2)24(31)33-25(21,4)23(30)22(17)26/h7-8,13-15,28H,5-6,9-12H2,1-4H3

> <INCHI_KEY>
HEYAIBWBZDUWFW-UHFFFAOYSA-N

> <FORMULA>
C25H30ClNO6

> <MOLECULAR_WEIGHT>
475.97

> <EXACT_MASS>
475.1761654

> <JCHEM_ACCEPTOR_COUNT>
6

> <JCHEM_ATOM_COUNT>
63

> <JCHEM_AVERAGE_POLARIZABILITY>
51.31132479295135

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
5-chloro-2-[2-(2-hydroxyethoxy)ethyl]-6a-methyl-3-(3-methylpent-1-en-1-yl)-9-propanoyl-2H,6H,6aH,8H-furo[2,3-h]isoquinoline-6,8-dione

> <JCHEM_LOGP>
3.0550088876666655

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
18.868273107839002

> <JCHEM_PKA_STRONGEST_ACIDIC>
15.121149169870005

> <JCHEM_PKA_STRONGEST_BASIC>
3.81253172776298

> <JCHEM_POLAR_SURFACE_AREA>
93.14000000000001

> <JCHEM_REFRACTIVITY>
130.2525

> <JCHEM_ROTATABLE_BOND_COUNT>
10

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
5-chloro-2-[2-(2-hydroxyethoxy)ethyl]-6a-methyl-3-(3-methylpent-1-en-1-yl)-9-propanoylfuro[2,3-h]isoquinoline-6,8-dione

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 05-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   05-SEP-22         0                                  
HETATM    1  C   UNK     0       1.187   8.465   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -0.320   8.785   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -1.350   7.640   0.000  0.00  0.00           C+0
HETATM    4  O   UNK     0      -0.874   6.176   0.000  0.00  0.00           O+0
HETATM    5  C   UNK     0      -2.857   7.960   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -4.001   6.930   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      -4.001   5.390   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -2.667   4.620   0.000  0.00  0.00           C+0
HETATM    9  N   UNK     0      -2.667   3.080   0.000  0.00  0.00           N+0
HETATM   10  C   UNK     0      -1.334   2.310   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -0.000   3.080   0.000  0.00  0.00           C+0
HETATM   12  O   UNK     0       1.334   2.310   0.000  0.00  0.00           O+0
HETATM   13  C   UNK     0       2.667   3.080   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       4.001   2.310   0.000  0.00  0.00           C+0
HETATM   15  O   UNK     0       5.335   3.080   0.000  0.00  0.00           O+0
HETATM   16  C   UNK     0      -4.001   2.310   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      -4.001   0.770   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      -2.667   0.000   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      -2.667  -1.540   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      -4.001  -2.310   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      -1.334  -2.310   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      -1.334  -3.850   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      -5.335   3.080   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      -5.335   4.620   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      -6.668   5.390   0.000  0.00  0.00           C+0
HETATM   26 Cl   UNK     0      -8.002   4.620   0.000  0.00  0.00          Cl+0
HETATM   27  C   UNK     0      -6.668   6.930   0.000  0.00  0.00           C+0
HETATM   28  O   UNK     0      -8.002   7.700   0.000  0.00  0.00           O+0
HETATM   29  C   UNK     0      -5.335   7.700   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0      -6.581   8.605   0.000  0.00  0.00           C+0
HETATM   31  O   UNK     0      -5.015   9.206   0.000  0.00  0.00           O+0
HETATM   32  C   UNK     0      -3.483   9.367   0.000  0.00  0.00           C+0
HETATM   33  O   UNK     0      -2.713  10.701   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3                                                       
CONECT    3    2    4    5                                                  
CONECT    4    3                                                            
CONECT    5    3    6   32                                                  
CONECT    6    5    7   29                                                  
CONECT    7    6    8   24                                                  
CONECT    8    7    9                                                       
CONECT    9    8   10   16                                                  
CONECT   10    9   11                                                       
CONECT   11   10   12                                                       
CONECT   12   11   13                                                       
CONECT   13   12   14                                                       
CONECT   14   13   15                                                       
CONECT   15   14                                                            
CONECT   16    9   17   23                                                  
CONECT   17   16   18                                                       
CONECT   18   17   19                                                       
CONECT   19   18   20   21                                                  
CONECT   20   19                                                            
CONECT   21   19   22                                                       
CONECT   22   21                                                            
CONECT   23   16   24                                                       
CONECT   24   23    7   25                                                  
CONECT   25   24   26   27                                                  
CONECT   26   25                                                            
CONECT   27   25   28   29                                                  
CONECT   28   27                                                            
CONECT   29   27    6   30   31                                             
CONECT   30   29                                                            
CONECT   31   29   32                                                       
CONECT   32   31    5   33                                                  
CONECT   33   32                                                            
MASTER        0    0    0    0    0    0    0    0   33    0   70    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₂₅H₃₀ClNO₆

Average Mass

475.9700 Da

Monoisotopic Mass

475.17617 Da

IUPAC Name

5-chloro-2-[2-(2-hydroxyethoxy)ethyl]-6a-methyl-3-(3-methylpent-1-en-1-yl)-9-propanoyl-2H,6H,6aH,8H-furo[2,3-h]isoquinoline-6,8-dione

Traditional Name

5-chloro-2-[2-(2-hydroxyethoxy)ethyl]-6a-methyl-3-(3-methylpent-1-en-1-yl)-9-propanoylfuro[2,3-h]isoquinoline-6,8-dione

CAS Registry Number

Not Available

SMILES

CCC(C)C=CC1=CC2=C(Cl)C(=O)C3(C)OC(=O)C(C(=O)CC)=C3C2=CN1CCOCCO

InChI Identifier

InChI=1S/C25H30ClNO6/c1-5-15(3)7-8-16-13-17-18(14-27(16)9-11-32-12-10-28)21-20(19(29)6-2)24(31)33-25(21,4)23(30)22(17)26/h7-8,13-15,28H,5-6,9-12H2,1-4H3

InChI Key

HEYAIBWBZDUWFW-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

Not Available

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as isoquinolones and derivatives. These are aromatic polycyclic compounds containing a ketone bearing isoquinoline moiety.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Isoquinolines and derivatives

Sub Class

Isoquinolones and derivatives

Direct Parent

Isoquinolones and derivatives

Alternative Parents

Substituents

Isoquinolone
Tetrahydroisoquinoline
Cyclohexenone
Alpha-acyloxy ketone
Dihydropyridine
2-furanone
Alpha-haloketone
Alpha-chloroketone
Alpha,beta-unsaturated carboxylic ester
Enoate ester
Dihydrofuran
Tertiary aliphatic amine
Tertiary amine
Lactone
Ketone
Carboxylic acid ester
Amino acid or derivatives
Allylamine
Oxacycle
Azacycle
Chloroalkene
Haloalkene
Vinyl halide
Vinyl chloride
Monocarboxylic acid or derivatives
Ether
Enamine
Dialkyl ether
Carboxylic acid derivative
Organic nitrogen compound
Organic oxygen compound
Organopnictogen compound
Organic oxide
Hydrocarbon derivative
Primary alcohol
Organooxygen compound
Organonitrogen compound
Organochloride
Organohalogen compound
Carbonyl group
Amine
Alcohol
Aliphatic heteropolycyclic compound

Molecular Framework

Aliphatic 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
logP	3.06	ChemAxon
pKa (Strongest Acidic)	15.12	ChemAxon
pKa (Strongest Basic)	3.81	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	6	ChemAxon
Hydrogen Donor Count	1	ChemAxon
Polar Surface Area	93.14 Å²	ChemAxon
Rotatable Bond Count	10	ChemAxon
Refractivity	130.25 m³·mol⁻¹	ChemAxon
Polarizability	51.31 Å³	ChemAxon
Number of Rings	3	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	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

162943046

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

LOTUS database [Link]

Showing NP-Card for 5-chloro-2-[2-(2-hydroxyethoxy)ethyl]-6a-methyl-3-(3-methylpent-1-en-1-yl)-9-propanoylfuro[2,3-h]isoquinoline-6,8-dione (NP0207820)

MOL for NP0207820 (5-chloro-2-[2-(2-hydroxyethoxy)ethyl]-6a-methyl-3-(3-methylpent-1-en-1-yl)-9-propanoylfuro[2,3-h]isoquinoline-6,8-dione)

3D MOL for NP0207820 (5-chloro-2-[2-(2-hydroxyethoxy)ethyl]-6a-methyl-3-(3-methylpent-1-en-1-yl)-9-propanoylfuro[2,3-h]isoquinoline-6,8-dione)

3D SDF for NP0207820 (5-chloro-2-[2-(2-hydroxyethoxy)ethyl]-6a-methyl-3-(3-methylpent-1-en-1-yl)-9-propanoylfuro[2,3-h]isoquinoline-6,8-dione)

3D-SDF for NP0207820 (5-chloro-2-[2-(2-hydroxyethoxy)ethyl]-6a-methyl-3-(3-methylpent-1-en-1-yl)-9-propanoylfuro[2,3-h]isoquinoline-6,8-dione)

PDB for NP0207820 (5-chloro-2-[2-(2-hydroxyethoxy)ethyl]-6a-methyl-3-(3-methylpent-1-en-1-yl)-9-propanoylfuro[2,3-h]isoquinoline-6,8-dione)

3D PDB for NP0207820 (5-chloro-2-[2-(2-hydroxyethoxy)ethyl]-6a-methyl-3-(3-methylpent-1-en-1-yl)-9-propanoylfuro[2,3-h]isoquinoline-6,8-dione)

SMILES for NP0207820 (5-chloro-2-[2-(2-hydroxyethoxy)ethyl]-6a-methyl-3-(3-methylpent-1-en-1-yl)-9-propanoylfuro[2,3-h]isoquinoline-6,8-dione)

INCHI for NP0207820 (5-chloro-2-[2-(2-hydroxyethoxy)ethyl]-6a-methyl-3-(3-methylpent-1-en-1-yl)-9-propanoylfuro[2,3-h]isoquinoline-6,8-dione)

Structure for NP0207820 (5-chloro-2-[2-(2-hydroxyethoxy)ethyl]-6a-methyl-3-(3-methylpent-1-en-1-yl)-9-propanoylfuro[2,3-h]isoquinoline-6,8-dione)

3D Structure for NP0207820 (5-chloro-2-[2-(2-hydroxyethoxy)ethyl]-6a-methyl-3-(3-methylpent-1-en-1-yl)-9-propanoylfuro[2,3-h]isoquinoline-6,8-dione)