NP-MRD: Showing NP-Card for Argenteane (NP0336613)

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Record Information

Version

2.0

Created at

2024-09-11 07:05:15 UTC

Updated at

2024-09-11 07:05:15 UTC

NP-MRD ID

NP0336613

Secondary Accession Numbers

None

Natural Product Identification

Common Name

Argenteane

Description

Argenteane was first documented in 2013 (PMID: 23560800). Based on a literature review very few articles have been published on Argenteane.

Structure

MOL SDF PDB SMILES InChI


  Mrv2104 05262309372D          

 48 53  0  0  0  0            999 V2000
   13.2815   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4223    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5671    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1368   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7092    2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9947   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7105   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9934    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4249   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2789    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9960    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7079   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8526   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8513    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4236   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2802    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4249    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2789   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1381    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5658   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4089   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2949    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2815   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4223    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5671    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1368   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7105   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9934    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1381    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5658   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7092    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9947   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1394   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5645    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1394   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5645    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4236    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2802   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7092    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9947   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9947    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7092   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4236    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.2802   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.9240   -1.4924    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7798    1.0799    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.9240   -0.1576    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7798   -0.2549    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  9  7  2  0  0  0  0
 10  8  2  0  0  0  0
 23  1  1  0  0  0  0
 23 11  1  0  0  0  0
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 36 18  1  0  0  0  0
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 37 19  2  0  0  0  0
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 39 37  1  0  0  0  0
 40 32  2  0  0  0  0
 40 38  1  0  0  0  0
 41 39  1  0  0  0  0
 42 40  1  0  0  0  0
 43  5  1  0  0  0  0
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 44  6  1  0  0  0  0
 44 38  1  0  0  0  0
 45 21  1  0  0  0  0
 45 33  1  0  0  0  0
 46 22  1  0  0  0  0
 46 34  1  0  0  0  0
 47 21  1  0  0  0  0
 47 35  1  0  0  0  0
 48 22  1  0  0  0  0
 48 36  1  0  0  0  0
M  END


  Mrv2104 05262309372D          

 48 53  0  0  0  0            999 V2000
   13.2815   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4223    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5671    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1368   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7092    2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9947   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7105   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9934    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4249   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2789    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9960    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7079   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8526   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8513    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4236   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2802    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4249    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2789   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1381    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5658   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4089   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2949    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2815   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4223    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5671    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1368   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7105   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9934    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1381    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5658   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7092    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9947   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1394   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5645    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1394   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5645    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4236    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2802   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7092    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9947   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9947    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7092   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4236    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.2802   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.9240   -1.4924    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7798    1.0799    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.9240   -0.1576    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7798   -0.2549    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  9  7  2  0  0  0  0
 10  8  2  0  0  0  0
 23  1  1  0  0  0  0
 23 11  1  0  0  0  0
 24  2  1  0  0  0  0
 24 12  1  0  0  0  0
 25  3  1  0  0  0  0
 25 13  1  0  0  0  0
 25 23  1  0  0  0  0
 26  4  1  0  0  0  0
 26 14  1  0  0  0  0
 26 24  1  0  0  0  0
 27  7  1  0  0  0  0
 27 11  1  0  0  0  0
 27 17  2  0  0  0  0
 28  8  1  0  0  0  0
 28 12  1  0  0  0  0
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 29 13  1  0  0  0  0
 29 15  2  0  0  0  0
 29 19  1  0  0  0  0
 30 14  1  0  0  0  0
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 31 15  1  0  0  0  0
 32 16  1  0  0  0  0
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 33  9  1  0  0  0  0
 34 10  1  0  0  0  0
 35 17  1  0  0  0  0
 35 33  2  0  0  0  0
 36 18  1  0  0  0  0
 36 34  2  0  0  0  0
 37 19  2  0  0  0  0
 38 20  2  0  0  0  0
 39 31  2  0  0  0  0
 39 37  1  0  0  0  0
 40 32  2  0  0  0  0
 40 38  1  0  0  0  0
 41 39  1  0  0  0  0
 42 40  1  0  0  0  0
 43  5  1  0  0  0  0
 43 37  1  0  0  0  0
 44  6  1  0  0  0  0
 44 38  1  0  0  0  0
 45 21  1  0  0  0  0
 45 33  1  0  0  0  0
 46 22  1  0  0  0  0
 46 34  1  0  0  0  0
 47 21  1  0  0  0  0
 47 35  1  0  0  0  0
 48 22  1  0  0  0  0
 48 36  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0336613

> <DATABASE_NAME>
NP-MRD

> <SMILES>
COC1=CC(CC(C)C(C)CC2=CC3=C(OCO3)C=C2)=CC(=C1O)C1=C(O)C(OC)=CC(CC(C)C(C)CC2=CC3=C(OCO3)C=C2)=C1

> <INCHI_IDENTIFIER>
InChI=1/C40H46O8/c1-23(11-27-7-9-33-35(17-27)47-21-45-33)25(3)13-29-15-31(39(41)37(19-29)43-5)32-16-30(20-38(44-6)40(32)42)14-26(4)24(2)12-28-8-10-34-36(18-28)48-22-46-34/h7-10,15-20,23-26,41-42H,11-14,21-22H2,1-6H3

> <INCHI_KEY>
CZIXJKXAQLINMJ-UHFFFAOYNA-N

> <FORMULA>
C40H46O8

> <MOLECULAR_WEIGHT>
654.8

> <EXACT_MASS>
654.319268441

> <JCHEM_ACCEPTOR_COUNT>
8

> <JCHEM_ATOM_COUNT>
94

> <JCHEM_AVERAGE_POLARIZABILITY>
72.89264211615352

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
2

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
5,5'-bis[4-(2H-1,3-benzodioxol-5-yl)-2,3-dimethylbutyl]-3,3'-dimethoxy-[1,1'-biphenyl]-2,2'-diol

> <JCHEM_LOGP>
9.943541368

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
6

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
14.06087268403305

> <JCHEM_PKA_STRONGEST_ACIDIC>
9.504276494369618

> <JCHEM_PKA_STRONGEST_BASIC>
-4.206743506689234

> <JCHEM_POLAR_SURFACE_AREA>
95.84000000000002

> <JCHEM_REFRACTIVITY>
184.89100000000002

> <JCHEM_ROTATABLE_BOND_COUNT>
13

> <JCHEM_RULE_OF_FIVE>
0

> <JCHEM_TRADITIONAL_IUPAC>
5,5'-bis[4-(2H-1,3-benzodioxol-5-yl)-2,3-dimethylbutyl]-3,3'-dimethoxy-[1,1'-biphenyl]-2,2'-diol

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 26-MAY-23   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   26-MAY-23         0                                  
HETATM    1  C   UNK     0      24.792  -2.310   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      10.122   1.540   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      23.459   1.540   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      11.455  -2.310   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      18.124   4.620   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      16.790  -5.390   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      27.460  -2.310   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       7.454   1.540   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      28.793  -3.080   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       6.121   2.310   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      26.126   0.000   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       8.788  -0.770   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      22.125  -0.770   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      12.789   0.000   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      19.457  -0.770   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      15.456   0.000   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      28.793   0.000   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       6.121  -0.770   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      20.791   1.540   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      14.123  -2.310   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      32.497  -1.540   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       2.417   0.770   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      24.792  -0.770   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      10.122   0.000   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      23.459   0.000   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0      11.455  -0.770   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0      27.460  -0.770   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0       7.454   0.000   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0      20.791   0.000   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0      14.123  -0.770   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0      18.124   0.000   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0      16.790  -0.770   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0      30.127  -2.310   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0       4.787   1.540   0.000  0.00  0.00           C+0
HETATM   35  C   UNK     0      30.127  -0.770   0.000  0.00  0.00           C+0
HETATM   36  C   UNK     0       4.787   0.000   0.000  0.00  0.00           C+0
HETATM   37  C   UNK     0      19.457   2.310   0.000  0.00  0.00           C+0
HETATM   38  C   UNK     0      15.456  -3.080   0.000  0.00  0.00           C+0
HETATM   39  C   UNK     0      18.124   1.540   0.000  0.00  0.00           C+0
HETATM   40  C   UNK     0      16.790  -2.310   0.000  0.00  0.00           C+0
HETATM   41  O   UNK     0      16.790   2.310   0.000  0.00  0.00           O+0
HETATM   42  O   UNK     0      18.124  -3.080   0.000  0.00  0.00           O+0
HETATM   43  O   UNK     0      19.457   3.850   0.000  0.00  0.00           O+0
HETATM   44  O   UNK     0      15.456  -4.620   0.000  0.00  0.00           O+0
HETATM   45  O   UNK     0      31.591  -2.786   0.000  0.00  0.00           O+0
HETATM   46  O   UNK     0       3.322   2.016   0.000  0.00  0.00           O+0
HETATM   47  O   UNK     0      31.591  -0.294   0.000  0.00  0.00           O+0
HETATM   48  O   UNK     0       3.322  -0.476   0.000  0.00  0.00           O+0
CONECT    1   23                                                            
CONECT    2   24                                                            
CONECT    3   25                                                            
CONECT    4   26                                                            
CONECT    5   43                                                            
CONECT    6   44                                                            
CONECT    7    9   27                                                       
CONECT    8   10   28                                                       
CONECT    9    7   33                                                       
CONECT   10    8   34                                                       
CONECT   11   23   27                                                       
CONECT   12   24   28                                                       
CONECT   13   25   29                                                       
CONECT   14   26   30                                                       
CONECT   15   29   31                                                       
CONECT   16   30   32                                                       
CONECT   17   27   35                                                       
CONECT   18   28   36                                                       
CONECT   19   29   37                                                       
CONECT   20   30   38                                                       
CONECT   21   45   47                                                       
CONECT   22   46   48                                                       
CONECT   23    1   11   25                                                  
CONECT   24    2   12   26                                                  
CONECT   25    3   13   23                                                  
CONECT   26    4   14   24                                                  
CONECT   27    7   11   17                                                  
CONECT   28    8   12   18                                                  
CONECT   29   13   15   19                                                  
CONECT   30   14   16   20                                                  
CONECT   31   15   32   39                                                  
CONECT   32   16   31   40                                                  
CONECT   33    9   35   45                                                  
CONECT   34   10   36   46                                                  
CONECT   35   17   33   47                                                  
CONECT   36   18   34   48                                                  
CONECT   37   19   39   43                                                  
CONECT   38   20   40   44                                                  
CONECT   39   31   37   41                                                  
CONECT   40   32   38   42                                                  
CONECT   41   39                                                            
CONECT   42   40                                                            
CONECT   43    5   37                                                       
CONECT   44    6   38                                                       
CONECT   45   21   33                                                       
CONECT   46   22   34                                                       
CONECT   47   21   35                                                       
CONECT   48   22   36                                                       
MASTER        0    0    0    0    0    0    0    0   48    0  106    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₄₀H₄₆O₈

Average Mass

654.8000 Da

Monoisotopic Mass

654.31927 Da

IUPAC Name

5,5'-bis[4-(2H-1,3-benzodioxol-5-yl)-2,3-dimethylbutyl]-3,3'-dimethoxy-[1,1'-biphenyl]-2,2'-diol

Traditional Name

5,5'-bis[4-(2H-1,3-benzodioxol-5-yl)-2,3-dimethylbutyl]-3,3'-dimethoxy-[1,1'-biphenyl]-2,2'-diol

CAS Registry Number

Not Available

SMILES

COC1=CC(CC(C)C(C)CC2=CC3=C(OCO3)C=C2)=CC(=C1O)C1=C(O)C(OC)=CC(CC(C)C(C)CC2=CC3=C(OCO3)C=C2)=C1

InChI Identifier

InChI=1/C40H46O8/c1-23(11-27-7-9-33-35(17-27)47-21-45-33)25(3)13-29-15-31(39(41)37(19-29)43-5)32-16-30(20-38(44-6)40(32)42)14-26(4)24(2)12-28-8-10-34-36(18-28)48-22-46-34/h7-10,15-20,23-26,41-42H,11-14,21-22H2,1-6H3

InChI Key

CZIXJKXAQLINMJ-UHFFFAOYNA-N

Experimental Spectra

Not Available

Predicted Spectra

Not Available

Chemical Shift Submissions

Not Available

Species

Species of Origin

Not Available

Chemical Taxonomy

Classification

Not classified

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	9.94	ChemAxon
pKa (Strongest Acidic)	9.5	ChemAxon
pKa (Strongest Basic)	-4.2	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	8	ChemAxon
Hydrogen Donor Count	2	ChemAxon
Polar Surface Area	95.84 Å²	ChemAxon
Rotatable Bond Count	13	ChemAxon
Refractivity	184.89 m³·mol⁻¹	ChemAxon
Polarizability	72.89 Å³	ChemAxon
Number of Rings	6	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

Not Available

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Podloucka P, Berka K, Fabre G, Paloncyova M, Duroux JL, Otyepka M, Trouillas P: Lipid bilayer membrane affinity rationalizes inhibition of lipid peroxidation by a natural lignan antioxidant. J Phys Chem B. 2013 May 2;117(17):5043-9. doi: 10.1021/jp3127829. Epub 2013 Apr 16. [PubMed:23560800 ]

Showing NP-Card for Argenteane (NP0336613)

MOL for NP0336613 (Argenteane)

3D MOL for NP0336613 (Argenteane)

3D SDF for NP0336613 (Argenteane)

3D-SDF for NP0336613 (Argenteane)

PDB for NP0336613 (Argenteane)

3D PDB for NP0336613 (Argenteane)

SMILES for NP0336613 (Argenteane)

INCHI for NP0336613 (Argenteane)

Structure for NP0336613 (Argenteane)

3D Structure for NP0336613 (Argenteane)