NP-MRD: Showing NP-Card for 4-(2-hydroxy-3-{[(9z)-8-hydroxyheptadeca-1,9-dien-4,6-diyn-3-yl]oxy}-3-methylbutoxy)furo[3,2-g]chromen-7-one (NP0280272)

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Record Information

Version

2.0

Created at

2022-09-09 05:57:51 UTC

Updated at

2022-09-09 05:57:51 UTC

NP-MRD ID

NP0280272

Secondary Accession Numbers

None

Natural Product Identification

Common Name

4-(2-hydroxy-3-{[(9z)-8-hydroxyheptadeca-1,9-dien-4,6-diyn-3-yl]oxy}-3-methylbutoxy)furo[3,2-g]chromen-7-one

Description

Japoangelol D belongs to the class of organic compounds known as psoralens. These are organic compounds containing a psoralen moiety, which consists of a furan fused to a chromenone to for 7H-furo[3,2-g]chromen-7-one. 4-(2-hydroxy-3-{[(9z)-8-hydroxyheptadeca-1,9-dien-4,6-diyn-3-yl]oxy}-3-methylbutoxy)furo[3,2-g]chromen-7-one is found in Angelica japonica. Based on a literature review very few articles have been published on Japoangelol D.

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1652309092207572D          

 40 42  0  0  0  0            999 V2000
    5.7158    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4302    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4302   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1447   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8592   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5737   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2881   -2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0026   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7171   -2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0026   -3.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7171   -3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4315   -3.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1460   -3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8605   -3.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5749   -3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2894   -3.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.5724   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
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  3  4  1  0  0  0  0
  4  5  3  0  0  0  0
  5  6  1  0  0  0  0
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  8 10  1  0  0  0  0
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 17 18  1  0  0  0  0
  3 19  1  0  0  0  0
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 38 39  2  0  0  0  0
 39 40  1  0  0  0  0
 27 40  1  0  0  0  0
 34 40  2  0  0  0  0
M  END

     RDKit          3D

 78 80  0  0  0  0  0  0  0  0999 V2000
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  2 43  1  0
  1 41  1  0
  1 42  1  0
M  END


  Mrv1652309092207572D          

 40 42  0  0  0  0            999 V2000
    5.7158    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4302    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.6005   -2.4570    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
    0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.8250    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
    0.7145    1.2375    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
    1.4289    0.0000    0.0000 C   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  1  0  0  0  0
  4  5  3  0  0  0  0
  5  6  1  0  0  0  0
  6  7  3  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
 10 11  2  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
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
  3 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  1  0  0  0  0
 20 23  1  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  2  0  0  0  0
 28 29  1  0  0  0  0
 29 30  2  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 28 32  1  0  0  0  0
 32 33  2  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 36 37  2  0  0  0  0
 36 38  1  0  0  0  0
 38 39  2  0  0  0  0
 39 40  1  0  0  0  0
 27 40  1  0  0  0  0
 34 40  2  0  0  0  0
M  END
> <DATABASE_ID>
NP0280272

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CCCCCCC\C=C/C(O)C#CC#CC(OC(C)(C)C(O)COC1=C2C=COC2=CC2=C1C=CC(=O)O2)C=C

> <INCHI_IDENTIFIER>
InChI=1S/C33H38O7/c1-5-7-8-9-10-11-12-15-24(34)16-13-14-17-25(6-2)40-33(3,4)30(35)23-38-32-26-18-19-31(36)39-29(26)22-28-27(32)20-21-37-28/h6,12,15,18-22,24-25,30,34-35H,2,5,7-11,23H2,1,3-4H3/b15-12-

> <INCHI_KEY>
ZUIYHSOAFCLTEN-QINSGFPZSA-N

> <FORMULA>
C33H38O7

> <MOLECULAR_WEIGHT>
546.66

> <EXACT_MASS>
546.261753564

> <JCHEM_ACCEPTOR_COUNT>
5

> <JCHEM_ATOM_COUNT>
78

> <JCHEM_AVERAGE_POLARIZABILITY>
61.92401522352594

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
2

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
4-(2-hydroxy-3-{[(9Z)-8-hydroxyheptadeca-1,9-dien-4,6-diyn-3-yl]oxy}-3-methylbutoxy)-7H-furo[3,2-g]chromen-7-one

> <JCHEM_LOGP>
6.698319741666665

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
13.686154523567946

> <JCHEM_PKA_STRONGEST_ACIDIC>
13.03953583141223

> <JCHEM_PKA_STRONGEST_BASIC>
-2.818144900612734

> <JCHEM_POLAR_SURFACE_AREA>
98.36000000000001

> <JCHEM_REFRACTIVITY>
157.2803

> <JCHEM_ROTATABLE_BOND_COUNT>
17

> <JCHEM_RULE_OF_FIVE>
0

> <JCHEM_TRADITIONAL_IUPAC>
4-(2-hydroxy-3-{[(9Z)-8-hydroxyheptadeca-1,9-dien-4,6-diyn-3-yl]oxy}-3-methylbutoxy)furo[3,2-g]chromen-7-one

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 09-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   09-SEP-22         0                                  
HETATM    1  C   UNK     0      10.669   1.540   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      12.003   0.770   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      12.003  -0.770   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      13.337  -1.540   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      14.670  -2.310   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      16.004  -3.080   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      17.338  -3.850   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      18.672  -4.620   0.000  0.00  0.00           C+0
HETATM    9  O   UNK     0      20.005  -3.850   0.000  0.00  0.00           O+0
HETATM   10  C   UNK     0      18.672  -6.160   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      20.005  -6.930   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      21.339  -6.160   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      22.673  -6.930   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      24.006  -6.160   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      25.340  -6.930   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      26.674  -6.160   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      28.007  -6.930   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      29.341  -6.160   0.000  0.00  0.00           C+0
HETATM   19  O   UNK     0      10.669  -1.540   0.000  0.00  0.00           O+0
HETATM   20  C   UNK     0       9.336  -0.770   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      10.106   0.564   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       8.566  -2.104   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0       8.002   0.000   0.000  0.00  0.00           C+0
HETATM   24  O   UNK     0       8.002   1.540   0.000  0.00  0.00           O+0
HETATM   25  C   UNK     0       6.668  -0.770   0.000  0.00  0.00           C+0
HETATM   26  O   UNK     0       5.335   0.000   0.000  0.00  0.00           O+0
HETATM   27  C   UNK     0       4.001  -0.770   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0       4.001  -2.310   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0       5.145  -3.340   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0       4.519  -4.747   0.000  0.00  0.00           C+0
HETATM   31  O   UNK     0       2.988  -4.586   0.000  0.00  0.00           O+0
HETATM   32  C   UNK     0       2.667  -3.080   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0       1.334  -2.310   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0       1.334  -0.770   0.000  0.00  0.00           C+0
HETATM   35  O   UNK     0       0.000   0.000   0.000  0.00  0.00           O+0
HETATM   36  C   UNK     0       0.000   1.540   0.000  0.00  0.00           C+0
HETATM   37  O   UNK     0      -1.334   2.310   0.000  0.00  0.00           O+0
HETATM   38  C   UNK     0       1.334   2.310   0.000  0.00  0.00           C+0
HETATM   39  C   UNK     0       2.667   1.540   0.000  0.00  0.00           C+0
HETATM   40  C   UNK     0       2.667   0.000   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3                                                       
CONECT    3    2    4   19                                                  
CONECT    4    3    5                                                       
CONECT    5    4    6                                                       
CONECT    6    5    7                                                       
CONECT    7    6    8                                                       
CONECT    8    7    9   10                                                  
CONECT    9    8                                                            
CONECT   10    8   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                                                       
CONECT   18   17                                                            
CONECT   19    3   20                                                       
CONECT   20   19   21   22   23                                             
CONECT   21   20                                                            
CONECT   22   20                                                            
CONECT   23   20   24   25                                                  
CONECT   24   23                                                            
CONECT   25   23   26                                                       
CONECT   26   25   27                                                       
CONECT   27   26   28   40                                                  
CONECT   28   27   29   32                                                  
CONECT   29   28   30                                                       
CONECT   30   29   31                                                       
CONECT   31   30   32                                                       
CONECT   32   31   28   33                                                  
CONECT   33   32   34                                                       
CONECT   34   33   35   40                                                  
CONECT   35   34   36                                                       
CONECT   36   35   37   38                                                  
CONECT   37   36                                                            
CONECT   38   36   39                                                       
CONECT   39   38   40                                                       
CONECT   40   39   27   34                                                  
MASTER        0    0    0    0    0    0    0    0   40    0   84    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₃₃H₃₈O₇

Average Mass

546.6600 Da

Monoisotopic Mass

546.26175 Da

IUPAC Name

4-(2-hydroxy-3-{[(9Z)-8-hydroxyheptadeca-1,9-dien-4,6-diyn-3-yl]oxy}-3-methylbutoxy)-7H-furo[3,2-g]chromen-7-one

Traditional Name

4-(2-hydroxy-3-{[(9Z)-8-hydroxyheptadeca-1,9-dien-4,6-diyn-3-yl]oxy}-3-methylbutoxy)furo[3,2-g]chromen-7-one

CAS Registry Number

Not Available

SMILES

CCCCCCC\C=C/C(O)C#CC#CC(OC(C)(C)C(O)COC1=C2C=COC2=CC2=C1C=CC(=O)O2)C=C

InChI Identifier

InChI=1S/C33H38O7/c1-5-7-8-9-10-11-12-15-24(34)16-13-14-17-25(6-2)40-33(3,4)30(35)23-38-32-26-18-19-31(36)39-29(26)22-28-27(32)20-21-37-28/h6,12,15,18-22,24-25,30,34-35H,2,5,7-11,23H2,1,3-4H3/b15-12-

InChI Key

ZUIYHSOAFCLTEN-QINSGFPZSA-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
Angelica japonica	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as psoralens. These are organic compounds containing a psoralen moiety, which consists of a furan fused to a chromenone to for 7H-furo[3,2-g]chromen-7-one.

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Coumarins and derivatives

Sub Class

Furanocoumarins

Direct Parent

Psoralens

Alternative Parents

Substituents

Psoralen
Benzopyran
1-benzopyran
Benzofuran
Fatty alcohol
Phenol ether
Alkyl aryl ether
Pyranone
Fatty acyl
Benzenoid
Pyran
Heteroaromatic compound
Furan
Secondary alcohol
Lactone
Dialkyl ether
Ether
Oxacycle
Organoheterocyclic compound
Alcohol
Hydrocarbon derivative
Organic oxygen compound
Organic oxide
Organooxygen compound
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
logP	6.7	ChemAxon
pKa (Strongest Acidic)	13.04	ChemAxon
pKa (Strongest Basic)	-2.8	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	5	ChemAxon
Hydrogen Donor Count	2	ChemAxon
Polar Surface Area	98.36 Å²	ChemAxon
Rotatable Bond Count	17	ChemAxon
Refractivity	157.28 m³·mol⁻¹	ChemAxon
Polarizability	61.92 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

8849488

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

10674138

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

LOTUS database [Link]

Showing NP-Card for 4-(2-hydroxy-3-{[(9z)-8-hydroxyheptadeca-1,9-dien-4,6-diyn-3-yl]oxy}-3-methylbutoxy)furo[3,2-g]chromen-7-one (NP0280272)

MOL for NP0280272 (4-(2-hydroxy-3-{[(9z)-8-hydroxyheptadeca-1,9-dien-4,6-diyn-3-yl]oxy}-3-methylbutoxy)furo[3,2-g]chromen-7-one)

3D MOL for NP0280272 (4-(2-hydroxy-3-{[(9z)-8-hydroxyheptadeca-1,9-dien-4,6-diyn-3-yl]oxy}-3-methylbutoxy)furo[3,2-g]chromen-7-one)

3D SDF for NP0280272 (4-(2-hydroxy-3-{[(9z)-8-hydroxyheptadeca-1,9-dien-4,6-diyn-3-yl]oxy}-3-methylbutoxy)furo[3,2-g]chromen-7-one)

3D-SDF for NP0280272 (4-(2-hydroxy-3-{[(9z)-8-hydroxyheptadeca-1,9-dien-4,6-diyn-3-yl]oxy}-3-methylbutoxy)furo[3,2-g]chromen-7-one)

PDB for NP0280272 (4-(2-hydroxy-3-{[(9z)-8-hydroxyheptadeca-1,9-dien-4,6-diyn-3-yl]oxy}-3-methylbutoxy)furo[3,2-g]chromen-7-one)

3D PDB for NP0280272 (4-(2-hydroxy-3-{[(9z)-8-hydroxyheptadeca-1,9-dien-4,6-diyn-3-yl]oxy}-3-methylbutoxy)furo[3,2-g]chromen-7-one)

SMILES for NP0280272 (4-(2-hydroxy-3-{[(9z)-8-hydroxyheptadeca-1,9-dien-4,6-diyn-3-yl]oxy}-3-methylbutoxy)furo[3,2-g]chromen-7-one)

INCHI for NP0280272 (4-(2-hydroxy-3-{[(9z)-8-hydroxyheptadeca-1,9-dien-4,6-diyn-3-yl]oxy}-3-methylbutoxy)furo[3,2-g]chromen-7-one)

Structure for NP0280272 (4-(2-hydroxy-3-{[(9z)-8-hydroxyheptadeca-1,9-dien-4,6-diyn-3-yl]oxy}-3-methylbutoxy)furo[3,2-g]chromen-7-one)

3D Structure for NP0280272 (4-(2-hydroxy-3-{[(9z)-8-hydroxyheptadeca-1,9-dien-4,6-diyn-3-yl]oxy}-3-methylbutoxy)furo[3,2-g]chromen-7-one)