NP-MRD: Showing NP-Card for (2s,3s)-2-(2-hydroxypropan-2-yl)-4,9-dimethoxy-2h,3h-naphtho[2,3-b]furan-3-ol (NP0266444)

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Record Information

Version

2.0

Created at

2022-09-08 10:47:28 UTC

Updated at

2022-09-08 10:47:28 UTC

NP-MRD ID

NP0266444

Secondary Accession Numbers

None

Natural Product Identification

Common Name

(2s,3s)-2-(2-hydroxypropan-2-yl)-4,9-dimethoxy-2h,3h-naphtho[2,3-b]furan-3-ol

Description

AVICENOL A belongs to the class of organic compounds known as naphthofurans. Naphthofurans are compounds containing a furan ring fused to a naphthalene moiety. Furan is a 5 membered- ring aromatic ring with four carbon and one oxygen atoms. Naphthalene is a polycyclic aromatic hydrocarbon made up of two fused benzene rings. (2s,3s)-2-(2-hydroxypropan-2-yl)-4,9-dimethoxy-2h,3h-naphtho[2,3-b]furan-3-ol is found in Avicennia marina. (2s,3s)-2-(2-hydroxypropan-2-yl)-4,9-dimethoxy-2h,3h-naphtho[2,3-b]furan-3-ol was first documented in 2005 (PMID: 15730299). Based on a literature review a small amount of articles have been published on AVICENOL A (PMID: 17500572).

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 42 44  0  0  0  0  0  0  0  0999 V2000
    1.2535    3.7762   -0.2068 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1593    2.8122    0.7973 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1578    1.4443    0.5818 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0028    0.7241    0.3727 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0532   -0.6499    0.1605 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2666   -1.3034    0.1583 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3652   -2.6752   -0.0495 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5158   -3.2309   -1.3367 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4418   -0.6061    0.3655 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6616   -1.2487    0.3655 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8232   -0.5409    0.5732 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7265    0.8055    0.7772 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5187    1.4927    0.7852 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3522    0.7723    0.5750 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3259   -1.1715   -0.0360 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.3397   -1.9992   -1.1552 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1114    0.0979   -0.2817 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.4664    0.0760    0.3835 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1064    1.4296    0.1235 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3755   -0.9656   -0.2068 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3128   -0.1794    1.7339 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3407    1.1201    0.3236 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2352    3.9612   -0.6082 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6055    4.7292    0.2631 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9561    3.4800   -1.0083 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5326   -3.6882   -1.4334 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7760   -4.0604   -1.4757 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3422   -2.5069   -2.1490 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6539   -2.3201    0.1962 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7681   -1.0543    0.5708 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6262    1.3830    0.9427 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4691    2.5603    0.9492 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6137   -1.6970    0.8778 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9749   -1.4948   -1.9253 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2437    0.2462   -1.3645 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7932    2.1998    0.8254 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2111    1.3533    0.1290 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8010    1.7568   -0.9042 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3189   -0.9677    0.3538 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6230   -0.7196   -1.2626 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9361   -1.9763   -0.1272 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3685   -1.1646    1.8524 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3 14  2  0
 14 13  1  0
 13 12  2  0
 12 11  1  0
 11 10  2  0
 10  9  1  0
  9  6  2  0
  6  7  1  0
  7  8  1  0
  6  5  1  0
  5  4  2  0
  4 22  1  0
 22 17  1  0
 17 15  1  0
 15 16  1  0
 17 18  1  0
 18 19  1  0
 18 20  1  0
 18 21  1  0
  4  3  1  0
  9 14  1  0
 15  5  1  0
  1 23  1  0
  1 24  1  0
  1 25  1  0
 13 32  1  0
 12 31  1  0
 11 30  1  0
 10 29  1  0
  8 26  1  0
  8 27  1  0
  8 28  1  0
 17 35  1  6
 15 33  1  1
 16 34  1  0
 19 36  1  0
 19 37  1  0
 19 38  1  0
 20 39  1  0
 20 40  1  0
 20 41  1  0
 21 42  1  0
M  END


  Mrv1652309082212472D          

 22 24  0  0  1  0            999 V2000
    1.4289    2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    2.0625    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
    2.8579    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.0000    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
    2.1434   -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
    1.4289    0.0000    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 C   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 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
    3.6425   -0.2549    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.8974   -1.0396    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1274    0.4125    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.9524    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7774    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9524   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9524    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6425    1.0799    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  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  6  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
  3 14  2  0  0  0  0
  9 14  1  0  0  0  0
  5 15  1  0  0  0  0
 15 16  1  1  0  0  0
 15 17  1  0  0  0  0
 17 18  1  6  0  0  0
 18 19  1  0  0  0  0
 18 20  1  0  0  0  0
 18 21  1  0  0  0  0
 17 22  1  0  0  0  0
  4 22  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0266444

> <DATABASE_NAME>
NP-MRD

> <SMILES>
COC1=C2C=CC=CC2=C(OC)C2=C1O[C@@H]([C@H]2O)C(C)(C)O

> <INCHI_IDENTIFIER>
InChI=1S/C17H20O5/c1-17(2,19)16-12(18)11-13(20-3)9-7-5-6-8-10(9)14(21-4)15(11)22-16/h5-8,12,16,18-19H,1-4H3/t12-,16-/m0/s1

> <INCHI_KEY>
ZIFQTGAHILVMCO-LRDDRELGSA-N

> <FORMULA>
C17H20O5

> <MOLECULAR_WEIGHT>
304.342

> <EXACT_MASS>
304.131073744

> <JCHEM_ACCEPTOR_COUNT>
5

> <JCHEM_ATOM_COUNT>
42

> <JCHEM_AVERAGE_POLARIZABILITY>
32.268839287126035

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
2

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
(2S,3S)-2-(2-hydroxypropan-2-yl)-4,9-dimethoxy-2H,3H-naphtho[2,3-b]furan-3-ol

> <JCHEM_LOGP>
1.6774178859999995

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
14.329972533137038

> <JCHEM_PKA_STRONGEST_ACIDIC>
12.796921515825595

> <JCHEM_PKA_STRONGEST_BASIC>
-3.1431701286730966

> <JCHEM_POLAR_SURFACE_AREA>
68.15

> <JCHEM_REFRACTIVITY>
81.43440000000002

> <JCHEM_ROTATABLE_BOND_COUNT>
3

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
(2S,3S)-2-(2-hydroxypropan-2-yl)-4,9-dimethoxy-2H,3H-naphtho[2,3-b]furan-3-ol

> <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       2.667   4.620   0.000  0.00  0.00           C+0
HETATM    2  O   UNK     0       4.001   3.850   0.000  0.00  0.00           O+0
HETATM    3  C   UNK     0       4.001   2.310   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       5.335   1.540   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       5.335   0.000   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       4.001  -0.770   0.000  0.00  0.00           C+0
HETATM    7  O   UNK     0       4.001  -2.310   0.000  0.00  0.00           O+0
HETATM    8  C   UNK     0       2.667  -3.080   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       2.667   0.000   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       1.334  -0.770   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -0.000   0.000   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       0.000   1.540   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       1.334   2.310   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       2.667   1.540   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       6.799  -0.476   0.000  0.00  0.00           C+0
HETATM   16  O   UNK     0       7.275  -1.941   0.000  0.00  0.00           O+0
HETATM   17  C   UNK     0       7.705   0.770   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       9.245   0.770   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      10.785   0.770   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       9.245  -0.770   0.000  0.00  0.00           C+0
HETATM   21  O   UNK     0       9.245   2.310   0.000  0.00  0.00           O+0
HETATM   22  O   UNK     0       6.799   2.016   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3                                                       
CONECT    3    2    4   14                                                  
CONECT    4    3    5   22                                                  
CONECT    5    4    6   15                                                  
CONECT    6    5    7    9                                                  
CONECT    7    6    8                                                       
CONECT    8    7                                                            
CONECT    9    6   10   14                                                  
CONECT   10    9   11                                                       
CONECT   11   10   12                                                       
CONECT   12   11   13                                                       
CONECT   13   12   14                                                       
CONECT   14   13    3    9                                                  
CONECT   15    5   16   17                                                  
CONECT   16   15                                                            
CONECT   17   15   18   22                                                  
CONECT   18   17   19   20   21                                             
CONECT   19   18                                                            
CONECT   20   18                                                            
CONECT   21   18                                                            
CONECT   22   17    4                                                       
MASTER        0    0    0    0    0    0    0    0   22    0   48    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₁₇H₂₀O₅

Average Mass

304.3420 Da

Monoisotopic Mass

304.13107 Da

IUPAC Name

(2S,3S)-2-(2-hydroxypropan-2-yl)-4,9-dimethoxy-2H,3H-naphtho[2,3-b]furan-3-ol

Traditional Name

(2S,3S)-2-(2-hydroxypropan-2-yl)-4,9-dimethoxy-2H,3H-naphtho[2,3-b]furan-3-ol

CAS Registry Number

Not Available

SMILES

COC1=C2C=CC=CC2=C(OC)C2=C1O[C@@H]([C@H]2O)C(C)(C)O

InChI Identifier

InChI=1S/C17H20O5/c1-17(2,19)16-12(18)11-13(20-3)9-7-5-6-8-10(9)14(21-4)15(11)22-16/h5-8,12,16,18-19H,1-4H3/t12-,16-/m0/s1

InChI Key

ZIFQTGAHILVMCO-LRDDRELGSA-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
Avicennia marina	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as naphthofurans. Naphthofurans are compounds containing a furan ring fused to a naphthalene moiety. Furan is a 5 membered- ring aromatic ring with four carbon and one oxygen atoms. Naphthalene is a polycyclic aromatic hydrocarbon made up of two fused benzene rings.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Naphthofurans

Sub Class

Not Available

Direct Parent

Naphthofurans

Alternative Parents

Substituents

Naphthofuran
Naphthalene
Coumaran
Anisole
Phenol ether
Alkyl aryl ether
Benzenoid
Tertiary alcohol
Secondary alcohol
Ether
Oxacycle
Alcohol
Hydrocarbon derivative
Organic oxygen compound
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	1.68	ChemAxon
pKa (Strongest Acidic)	12.8	ChemAxon
pKa (Strongest Basic)	-3.1	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	5	ChemAxon
Hydrogen Donor Count	2	ChemAxon
Polar Surface Area	68.15 Å²	ChemAxon
Rotatable Bond Count	3	ChemAxon
Refractivity	81.43 m³·mol⁻¹	ChemAxon
Polarizability	32.27 Å³	ChemAxon
Number of Rings	3	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

C00032745

Chemspider ID

9383974

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

11208912

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Han L, Huang X, Dahse HM, Moellmann U, Fu H, Grabley S, Sattler I, Lin W: Unusual naphthoquinone derivatives from the twigs of Avicennia marina. J Nat Prod. 2007 Jun;70(6):923-7. doi: 10.1021/np060587g. Epub 2007 May 15. [PubMed:17500572 ]
Zou Y, Lobera M, Snider BB: Synthesis of 2,3-dihydro-3-hydroxy-2-hydroxylalkylbenzofurans from epoxy aldehydes. One-step syntheses of brosimacutin G, vaginidiol, vaginol, smyrindiol, xanthoarnol, and Avicenol A. Biomimetic syntheses of angelicin and psoralen. J Org Chem. 2005 Mar 4;70(5):1761-70. doi: 10.1021/jo047974k. [PubMed:15730299 ]
LOTUS database [Link]

Showing NP-Card for (2s,3s)-2-(2-hydroxypropan-2-yl)-4,9-dimethoxy-2h,3h-naphtho[2,3-b]furan-3-ol (NP0266444)

MOL for NP0266444 ((2s,3s)-2-(2-hydroxypropan-2-yl)-4,9-dimethoxy-2h,3h-naphtho[2,3-b]furan-3-ol)

3D MOL for NP0266444 ((2s,3s)-2-(2-hydroxypropan-2-yl)-4,9-dimethoxy-2h,3h-naphtho[2,3-b]furan-3-ol)

3D SDF for NP0266444 ((2s,3s)-2-(2-hydroxypropan-2-yl)-4,9-dimethoxy-2h,3h-naphtho[2,3-b]furan-3-ol)

3D-SDF for NP0266444 ((2s,3s)-2-(2-hydroxypropan-2-yl)-4,9-dimethoxy-2h,3h-naphtho[2,3-b]furan-3-ol)

PDB for NP0266444 ((2s,3s)-2-(2-hydroxypropan-2-yl)-4,9-dimethoxy-2h,3h-naphtho[2,3-b]furan-3-ol)

3D PDB for NP0266444 ((2s,3s)-2-(2-hydroxypropan-2-yl)-4,9-dimethoxy-2h,3h-naphtho[2,3-b]furan-3-ol)

SMILES for NP0266444 ((2s,3s)-2-(2-hydroxypropan-2-yl)-4,9-dimethoxy-2h,3h-naphtho[2,3-b]furan-3-ol)

INCHI for NP0266444 ((2s,3s)-2-(2-hydroxypropan-2-yl)-4,9-dimethoxy-2h,3h-naphtho[2,3-b]furan-3-ol)

Structure for NP0266444 ((2s,3s)-2-(2-hydroxypropan-2-yl)-4,9-dimethoxy-2h,3h-naphtho[2,3-b]furan-3-ol)

3D Structure for NP0266444 ((2s,3s)-2-(2-hydroxypropan-2-yl)-4,9-dimethoxy-2h,3h-naphtho[2,3-b]furan-3-ol)