NP-MRD: Showing NP-Card for iridodial glucoside (NP0242879)

Jump To Section:

Identification Spectra BioTaxonomy ChemoTaxonomy Physical properties Links References XML

Record Information

Version

2.0

Created at

2022-09-07 03:18:14 UTC

Updated at

2022-09-07 03:18:15 UTC

NP-MRD ID

NP0242879

Secondary Accession Numbers

None

Natural Product Identification

Common Name

iridodial glucoside

Description

Iridodial glucoside belongs to the class of organic compounds known as iridoid o-glycosides. These are iridoid monoterpenes containing a glycosyl (usually a pyranosyl) moiety linked to the iridoid skeleton. Thus, iridodial glucoside is considered to be an isoprenoid. iridodial glucoside is found in Verbena officinalis. iridodial glucoside was first documented in 2019 (PMID: 30576968). Based on a literature review very few articles have been published on Iridodial glucoside.

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 49 51  0  0  0  0  0  0  0  0999 V2000
   -4.7154    1.5804    2.0304 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3551    1.1996    1.5687 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3372    1.8515    2.0646 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0796    1.5212    1.6575 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7777    0.7231    0.5314 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.3335   -0.0331    0.8975 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4713    0.2791    0.1569 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.9048   -0.7608   -0.6519 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2921   -0.7658   -0.7567 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.7128   -1.6846   -1.8772 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1526   -1.2256   -3.0670 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8374   -1.1719    0.5711 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.2038   -1.4336    0.5426 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5564   -0.0621    1.5521 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.2225   -0.5604    2.8088 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5441    0.8725    1.0018 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.1068    2.0034    0.3771 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8666   -0.1776    0.1031 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.9554   -0.1474   -1.4288 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.9886   -1.0654   -2.0870 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4019   -0.5856   -1.6253 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0875    0.3902   -0.6571 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2298    0.1238    0.5909 C   0  0  2  0  0  0  0  0  0  0  0  0
   -5.4907    1.2966    1.2708 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0017    1.0745    2.9762 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8147    2.6611    2.2087 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4525    2.6439    2.7866 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4755    1.4136   -0.3009 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1449    1.0919   -0.5600 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6834    0.2363   -1.0147 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3733   -2.7219   -1.7276 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8068   -1.6946   -2.0088 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2256   -0.2234   -3.1048 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3502   -2.0976    0.9706 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3196   -2.2891    0.0475 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5198    0.5084    1.6819 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5514   -1.2957    2.7240 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0157    1.3161    1.9015 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4722    2.7824    0.4532 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6210   -1.2446    0.3531 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8530    0.8666   -1.8134 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5461   -1.8301   -1.4202 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5119   -1.5836   -2.9191 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1844   -0.4576   -2.5488 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5626   -1.5897   -1.1642 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7541   -0.4915   -2.6485 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8927    1.4090   -1.0056 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1314    0.1377   -0.4897 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7140   -0.7900    1.0488 H   0  0  0  0  0  0  0  0  0  0  0  0
 20 19  1  0
 19 21  1  0
 21 22  1  0
 22 23  1  0
 23 18  1  0
 18  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
  9 12  1  0
 12 13  1  0
 12 14  1  0
 14 15  1  0
 14 16  1  0
 16 17  1  0
  5  4  1  0
  4  3  1  0
  3  2  2  0
  2  1  1  0
 18 19  1  0
 16  7  1  0
  2 23  1  0
 20 42  1  0
 20 43  1  0
 20 44  1  0
 19 41  1  6
 21 45  1  0
 21 46  1  0
 22 47  1  0
 22 48  1  0
 23 49  1  1
 18 40  1  6
  5 28  1  6
  7 29  1  6
  9 30  1  6
 10 31  1  0
 10 32  1  0
 11 33  1  0
 12 34  1  1
 13 35  1  0
 14 36  1  1
 15 37  1  0
 16 38  1  1
 17 39  1  0
  3 27  1  0
  1 24  1  0
  1 25  1  0
  1 26  1  0
M  END


  Mrv1652309072205182D          

 23 25  0  0  1  0            999 V2000
    3.2789    2.0625    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
    3.9934    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9934    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2789   -0.4125    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.2789   -1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9934   -1.6500    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.9934   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7079   -2.8875    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.7079   -3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9934   -4.1250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4223   -2.4750    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.1368   -2.8875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4223   -1.6500    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.1368   -1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7079   -1.2375    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.7079   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5645    0.0000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.7798   -0.2549    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.5249   -1.0396    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
    1.7798    1.0799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5645    0.8250    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  1  0  0  0
  7  6  1  1  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  1  0  0  0
 10 11  1  0  0  0  0
  9 12  1  0  0  0  0
 12 13  1  6  0  0  0
 12 14  1  0  0  0  0
 14 15  1  1  0  0  0
 14 16  1  0  0  0  0
  7 16  1  0  0  0  0
 16 17  1  6  0  0  0
  5 18  1  0  0  0  0
 18 19  1  6  0  0  0
 19 20  1  1  0  0  0
 19 21  1  0  0  0  0
 21 22  1  0  0  0  0
 23 22  1  6  0  0  0
  2 23  1  0  0  0  0
 18 23  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0242879

> <DATABASE_NAME>
NP-MRD

> <SMILES>
C[C@H]1CC[C@H]2[C@@H]1[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC=C2C

> <INCHI_IDENTIFIER>
InChI=1S/C16H26O7/c1-7-3-4-9-8(2)6-21-15(11(7)9)23-16-14(20)13(19)12(18)10(5-17)22-16/h6-7,9-20H,3-5H2,1-2H3/t7-,9+,10+,11+,12+,13-,14+,15-,16-/m0/s1

> <INCHI_KEY>
UKWQRDBDDIGHEQ-MDHPXLNESA-N

> <FORMULA>
C16H26O7

> <MOLECULAR_WEIGHT>
330.377

> <EXACT_MASS>
330.167853177

> <JCHEM_ACCEPTOR_COUNT>
7

> <JCHEM_ATOM_COUNT>
49

> <JCHEM_AVERAGE_POLARIZABILITY>
34.25490153622876

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
4

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
(2S,3R,4S,5S,6R)-2-{[(1S,4aS,7S,7aR)-4,7-dimethyl-1H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyran-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

> <JCHEM_LOGP>
-0.09930065566666704

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
13.198724998154692

> <JCHEM_PKA_STRONGEST_ACIDIC>
12.207031727235726

> <JCHEM_PKA_STRONGEST_BASIC>
-2.981084760151184

> <JCHEM_POLAR_SURFACE_AREA>
108.61000000000001

> <JCHEM_REFRACTIVITY>
79.39559999999999

> <JCHEM_ROTATABLE_BOND_COUNT>
3

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
iridodial glucoside

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 07-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   07-SEP-22         0                                  
HETATM    1  C   UNK     0       6.121   3.850   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       6.121   2.310   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       7.454   1.540   0.000  0.00  0.00           C+0
HETATM    4  O   UNK     0       7.454   0.000   0.000  0.00  0.00           O+0
HETATM    5  C   UNK     0       6.121  -0.770   0.000  0.00  0.00           C+0
HETATM    6  O   UNK     0       6.121  -2.310   0.000  0.00  0.00           O+0
HETATM    7  C   UNK     0       7.454  -3.080   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0       7.454  -4.620   0.000  0.00  0.00           O+0
HETATM    9  C   UNK     0       8.788  -5.390   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       8.788  -6.930   0.000  0.00  0.00           C+0
HETATM   11  O   UNK     0       7.454  -7.700   0.000  0.00  0.00           O+0
HETATM   12  C   UNK     0      10.122  -4.620   0.000  0.00  0.00           C+0
HETATM   13  O   UNK     0      11.455  -5.390   0.000  0.00  0.00           O+0
HETATM   14  C   UNK     0      10.122  -3.080   0.000  0.00  0.00           C+0
HETATM   15  O   UNK     0      11.455  -2.310   0.000  0.00  0.00           O+0
HETATM   16  C   UNK     0       8.788  -2.310   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0       8.788  -0.770   0.000  0.00  0.00           O+0
HETATM   18  C   UNK     0       4.787   0.000   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       3.322  -0.476   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       2.846  -1.941   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       2.417   0.770   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       3.322   2.016   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0       4.787   1.540   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3   23                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5                                                       
CONECT    5    4    6   18                                                  
CONECT    6    5    7                                                       
CONECT    7    6    8   16                                                  
CONECT    8    7    9                                                       
CONECT    9    8   10   12                                                  
CONECT   10    9   11                                                       
CONECT   11   10                                                            
CONECT   12    9   13   14                                                  
CONECT   13   12                                                            
CONECT   14   12   15   16                                                  
CONECT   15   14                                                            
CONECT   16   14    7   17                                                  
CONECT   17   16                                                            
CONECT   18    5   19   23                                                  
CONECT   19   18   20   21                                                  
CONECT   20   19                                                            
CONECT   21   19   22                                                       
CONECT   22   21   23                                                       
CONECT   23   22    2   18                                                  
MASTER        0    0    0    0    0    0    0    0   23    0   50    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₁₆H₂₆O₇

Average Mass

330.3770 Da

Monoisotopic Mass

330.16785 Da

IUPAC Name

(2S,3R,4S,5S,6R)-2-{[(1S,4aS,7S,7aR)-4,7-dimethyl-1H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyran-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

Traditional Name

iridodial glucoside

CAS Registry Number

Not Available

SMILES

C[C@H]1CC[C@H]2[C@@H]1[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC=C2C

InChI Identifier

InChI=1S/C16H26O7/c1-7-3-4-9-8(2)6-21-15(11(7)9)23-16-14(20)13(19)12(18)10(5-17)22-16/h6-7,9-20H,3-5H2,1-2H3/t7-,9+,10+,11+,12+,13-,14+,15-,16-/m0/s1

InChI Key

UKWQRDBDDIGHEQ-MDHPXLNESA-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
Verbena officinalis	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as iridoid o-glycosides. These are iridoid monoterpenes containing a glycosyl (usually a pyranosyl) moiety linked to the iridoid skeleton.

Kingdom

Organic compounds

Super Class

Lipids and lipid-like molecules

Class

Prenol lipids

Sub Class

Terpene glycosides

Direct Parent

Iridoid O-glycosides

Alternative Parents

Substituents

Iridoid o-glycoside
Hexose monosaccharide
Glycosyl compound
Iridoid-skeleton
O-glycosyl compound
Bicyclic monoterpenoid
Monoterpenoid
Monosaccharide
Oxane
Secondary alcohol
Acetal
Oxacycle
Organoheterocyclic compound
Polyol
Alcohol
Hydrocarbon derivative
Primary alcohol
Organic oxygen compound
Organooxygen compound
Aliphatic heteropolycyclic compound

Molecular Framework

Aliphatic heteropolycyclic compounds

External Descriptors

terpene glycoside (CHEBI:5965 )
Iridoid, 10-alkyliridoid and secoiridoid monoterpenoids (C11670 )
Iridoid, 10-alkyliridoid and secoiridoid monoterpenoids (LMPR0102070035 )

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	-0.099	ChemAxon
pKa (Strongest Acidic)	12.21	ChemAxon
pKa (Strongest Basic)	-3	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	7	ChemAxon
Hydrogen Donor Count	4	ChemAxon
Polar Surface Area	108.61 Å²	ChemAxon
Rotatable Bond Count	3	ChemAxon
Refractivity	79.4 m³·mol⁻¹	ChemAxon
Polarizability	34.25 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

Not Available

Chemspider ID

391587

KEGG Compound ID

C11670

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

443351

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Gousiadou C, Kokubun T, Albach DC, Gotfredsen CH, Jensen SR: Iridoid glucosides in the genus Sutera (Scrophulariaceae) as chemotaxonomic markers in tribe Limoselleae. Phytochemistry. 2019 Feb;158:149-155. doi: 10.1016/j.phytochem.2018.10.021. Epub 2018 Dec 18. [PubMed:30576968 ]
LOTUS database [Link]

Showing NP-Card for iridodial glucoside (NP0242879)

MOL for NP0242879 (iridodial glucoside)

3D MOL for NP0242879 (iridodial glucoside)

3D SDF for NP0242879 (iridodial glucoside)

3D-SDF for NP0242879 (iridodial glucoside)

PDB for NP0242879 (iridodial glucoside)

3D PDB for NP0242879 (iridodial glucoside)

SMILES for NP0242879 (iridodial glucoside)

INCHI for NP0242879 (iridodial glucoside)

Structure for NP0242879 (iridodial glucoside)

3D Structure for NP0242879 (iridodial glucoside)