NP-MRD: Showing NP-Card for 5-(hydroxymethyl)-12-(4-hydroxyphenyl)-17-(methoxymethyl)-15-methyl-2,4,9,13-tetraoxatetracyclo[8.7.1.0³,⁸.0¹⁴,¹⁸]octadeca-1(18),14,16-triene-6,7,16-triol (NP0328259)

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Record Information

Version

1.0

Created at

2022-09-12 11:34:36 UTC

Updated at

2022-09-12 11:34:36 UTC

NP-MRD ID

NP0328259

Secondary Accession Numbers

None

Natural Product Identification

Common Name

5-(hydroxymethyl)-12-(4-hydroxyphenyl)-17-(methoxymethyl)-15-methyl-2,4,9,13-tetraoxatetracyclo[8.7.1.0³,⁸.0¹⁴,¹⁸]octadeca-1(18),14,16-triene-6,7,16-triol

Description

5-(Hydroxymethyl)-12-(4-hydroxyphenyl)-17-(methoxymethyl)-15-methyl-2,4,9,13-tetraoxatetracyclo[8.7.1.0³,⁸.0¹⁴,¹⁸]Octadeca-1(17),14(18),15-triene-6,7,16-triol belongs to the class of organic compounds known as 7-hydroxyflavonoids. These are flavonoids that bear one hydroxyl group at the C-7 position of the flavonoid skeleton. 5-(hydroxymethyl)-12-(4-hydroxyphenyl)-17-(methoxymethyl)-15-methyl-2,4,9,13-tetraoxatetracyclo[8.7.1.0³,⁸.0¹⁴,¹⁸]octadeca-1(18),14,16-triene-6,7,16-triol is found in Pronephrium penangianum. 5-(Hydroxymethyl)-12-(4-hydroxyphenyl)-17-(methoxymethyl)-15-methyl-2,4,9,13-tetraoxatetracyclo[8.7.1.0³,⁸.0¹⁴,¹⁸]Octadeca-1(17),14(18),15-triene-6,7,16-triol is an extremely weak basic (essentially neutral) compound (based on its pKa).

Structure

MOL SDF PDB SMILES InChI


  Mrv1533004251513372D          

 34 38  0  0  0  0            999 V2000
    3.7781   -2.2966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1472   -1.7650    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3714   -2.0457    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7404   -1.5141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9521   -1.7573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7685   -2.5616    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3473   -1.1961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4410   -1.4393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5309   -0.3918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0739    0.1693    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1097    0.9736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8981    1.2168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5028    0.6557    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2461    1.0136    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9894    0.6557    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5942    1.2168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4106    2.0211    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3825    0.9736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9873    1.5348    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5661    0.1693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3545   -0.0738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5380   -0.8782    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9613   -0.3918    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1730   -0.1486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6586   -0.7937    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8336   -0.7937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3192   -0.1486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4951    1.5348    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2834    1.2916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8882    1.8528    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7046    2.6571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3094    3.2182    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9163    2.9002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3115    2.3391    0.0000 C   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
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  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
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 20 23  1  0  0  0  0
 23 24  1  0  0  0  0
 15 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
  4 26  1  0  0  0  0
 26 27  2  0  0  0  0
  9 27  1  0  0  0  0
 13 27  1  0  0  0  0
 11 28  1  0  0  0  0
 28 29  2  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 31 32  1  0  0  0  0
 31 33  1  0  0  0  0
 33 34  2  0  0  0  0
 28 34  1  0  0  0  0
M  END


  Mrv1533004251513372D          

 34 38  0  0  0  0            999 V2000
    3.7781   -2.2966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1472   -1.7650    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3714   -2.0457    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7404   -1.5141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9521   -1.7573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7685   -2.5616    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3473   -1.1961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4410   -1.4393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5309   -0.3918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0739    0.1693    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1097    0.9736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8981    1.2168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5028    0.6557    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2461    1.0136    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9894    0.6557    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5942    1.2168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4106    2.0211    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3825    0.9736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9873    1.5348    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5661    0.1693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3545   -0.0738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5380   -0.8782    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9613   -0.3918    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1730   -0.1486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6586   -0.7937    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8336   -0.7937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3192   -0.1486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4951    1.5348    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2834    1.2916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8882    1.8528    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7046    2.6571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3094    3.2182    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9163    2.9002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3115    2.3391    0.0000 C   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
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  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
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 20 23  1  0  0  0  0
 23 24  1  0  0  0  0
 15 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
  4 26  1  0  0  0  0
 26 27  2  0  0  0  0
  9 27  1  0  0  0  0
 13 27  1  0  0  0  0
 11 28  1  0  0  0  0
 28 29  2  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 31 32  1  0  0  0  0
 31 33  1  0  0  0  0
 33 34  2  0  0  0  0
 28 34  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0328259

> <DATABASE_NAME>
NP-MRD

> <SMILES>
COCC1=C(O)C(C)=C2OC(CC3OC4C(O)C(O)C(CO)OC4OC1=C23)C1=CC=C(O)C=C1

> <INCHI_IDENTIFIER>
InChI=1S/C24H28O10/c1-10-18(27)13(9-30-2)22-17-15(7-14(31-21(10)17)11-3-5-12(26)6-4-11)32-23-20(29)19(28)16(8-25)33-24(23)34-22/h3-6,14-16,19-20,23-29H,7-9H2,1-2H3

> <INCHI_KEY>
JFVFNGFBNXMZAT-UHFFFAOYSA-N

> <FORMULA>
C24H28O10

> <MOLECULAR_WEIGHT>
476.478

> <EXACT_MASS>
476.168247102

> <JCHEM_ACCEPTOR_COUNT>
10

> <JCHEM_ATOM_COUNT>
62

> <JCHEM_AVERAGE_POLARIZABILITY>
49.65049205995283

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
5

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
5-(hydroxymethyl)-12-(4-hydroxyphenyl)-17-(methoxymethyl)-15-methyl-2,4,9,13-tetraoxatetracyclo[8.7.1.0³,⁸.0¹⁴,¹⁸]octadeca-1(18),14,16-triene-6,7,16-triol

> <ALOGPS_LOGP>
0.53

> <JCHEM_LOGP>
1.1528044756666662

> <ALOGPS_LOGS>
-2.79

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
5

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
9.69544244210561

> <JCHEM_PKA_STRONGEST_ACIDIC>
9.07683769223934

> <JCHEM_PKA_STRONGEST_BASIC>
-2.9810925573746916

> <JCHEM_POLAR_SURFACE_AREA>
147.3

> <JCHEM_REFRACTIVITY>
117.3718

> <JCHEM_ROTATABLE_BOND_COUNT>
4

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
7.76e-01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
5-(hydroxymethyl)-12-(4-hydroxyphenyl)-17-(methoxymethyl)-15-methyl-2,4,9,13-tetraoxatetracyclo[8.7.1.0³,⁸.0¹⁴,¹⁸]octadeca-1(18),14,16-triene-6,7,16-triol

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 25-APR-15   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   25-APR-15         0                                  
HETATM    1  C   UNK     0       7.052  -4.287   0.000  0.00  0.00           C+0
HETATM    2  O   UNK     0       5.875  -3.295   0.000  0.00  0.00           O+0
HETATM    3  C   UNK     0       4.427  -3.819   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       3.249  -2.826   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       1.777  -3.280   0.000  0.00  0.00           C+0
HETATM    6  O   UNK     0       1.435  -4.782   0.000  0.00  0.00           O+0
HETATM    7  C   UNK     0       0.648  -2.233   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -0.823  -2.687   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       0.991  -0.731   0.000  0.00  0.00           C+0
HETATM   10  O   UNK     0      -0.138   0.316   0.000  0.00  0.00           O+0
HETATM   11  C   UNK     0       0.205   1.817   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       1.676   2.271   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       2.805   1.224   0.000  0.00  0.00           C+0
HETATM   14  O   UNK     0       4.193   1.892   0.000  0.00  0.00           O+0
HETATM   15  C   UNK     0       5.580   1.224   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       6.709   2.271   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0       6.366   3.773   0.000  0.00  0.00           O+0
HETATM   18  C   UNK     0       8.181   1.817   0.000  0.00  0.00           C+0
HETATM   19  O   UNK     0       9.310   2.865   0.000  0.00  0.00           O+0
HETATM   20  C   UNK     0       8.523   0.316   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       9.995  -0.138   0.000  0.00  0.00           C+0
HETATM   22  O   UNK     0      10.338  -1.639   0.000  0.00  0.00           O+0
HETATM   23  O   UNK     0       7.395  -0.731   0.000  0.00  0.00           O+0
HETATM   24  C   UNK     0       5.923  -0.277   0.000  0.00  0.00           C+0
HETATM   25  O   UNK     0       4.963  -1.481   0.000  0.00  0.00           O+0
HETATM   26  C   UNK     0       3.423  -1.481   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0       2.463  -0.277   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0      -0.924   2.865   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0      -2.396   2.411   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0      -3.525   3.458   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0      -3.182   4.960   0.000  0.00  0.00           C+0
HETATM   32  O   UNK     0      -4.311   6.007   0.000  0.00  0.00           O+0
HETATM   33  C   UNK     0      -1.710   5.414   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0      -0.581   4.366   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3                                                       
CONECT    3    2    4                                                       
CONECT    4    3    5   26                                                  
CONECT    5    4    6    7                                                  
CONECT    6    5                                                            
CONECT    7    5    8    9                                                  
CONECT    8    7                                                            
CONECT    9    7   10   27                                                  
CONECT   10    9   11                                                       
CONECT   11   10   12   28                                                  
CONECT   12   11   13                                                       
CONECT   13   12   14   27                                                  
CONECT   14   13   15                                                       
CONECT   15   14   16   24                                                  
CONECT   16   15   17   18                                                  
CONECT   17   16                                                            
CONECT   18   16   19   20                                                  
CONECT   19   18                                                            
CONECT   20   18   21   23                                                  
CONECT   21   20   22                                                       
CONECT   22   21                                                            
CONECT   23   20   24                                                       
CONECT   24   23   15   25                                                  
CONECT   25   24   26                                                       
CONECT   26   25    4   27                                                  
CONECT   27   26    9   13                                                  
CONECT   28   11   29   34                                                  
CONECT   29   28   30                                                       
CONECT   30   29   31                                                       
CONECT   31   30   32   33                                                  
CONECT   32   31                                                            
CONECT   33   31   34                                                       
CONECT   34   33   28                                                       
MASTER        0    0    0    0    0    0    0    0   34    0   76    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₂₄H₂₈O₁₀

Average Mass

476.4780 Da

Monoisotopic Mass

476.16825 Da

IUPAC Name

5-(hydroxymethyl)-12-(4-hydroxyphenyl)-17-(methoxymethyl)-15-methyl-2,4,9,13-tetraoxatetracyclo[8.7.1.0³,⁸.0¹⁴,¹⁸]octadeca-1(18),14,16-triene-6,7,16-triol

Traditional Name

5-(hydroxymethyl)-12-(4-hydroxyphenyl)-17-(methoxymethyl)-15-methyl-2,4,9,13-tetraoxatetracyclo[8.7.1.0³,⁸.0¹⁴,¹⁸]octadeca-1(18),14,16-triene-6,7,16-triol

CAS Registry Number

Not Available

SMILES

COCC1=C(O)C(C)=C2OC(CC3OC4C(O)C(O)C(CO)OC4OC1=C23)C1=CC=C(O)C=C1

InChI Identifier

InChI=1S/C24H28O10/c1-10-18(27)13(9-30-2)22-17-15(7-14(31-21(10)17)11-3-5-12(26)6-4-11)32-23-20(29)19(28)16(8-25)33-24(23)34-22/h3-6,14-16,19-20,23-29H,7-9H2,1-2H3

InChI Key

JFVFNGFBNXMZAT-UHFFFAOYSA-N

Experimental Spectra

Not Available

Predicted Spectra

Not Available

Chemical Shift Submissions

Not Available

Species

Species of Origin

Species Name	Source	Reference
Menisciopsis penangiana	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as 7-hydroxyflavonoids. These are flavonoids that bear one hydroxyl group at the C-7 position of the flavonoid skeleton.

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Flavonoids

Sub Class

Hydroxyflavonoids

Direct Parent

7-hydroxyflavonoids

Alternative Parents

Substituents

4'-hydroxyflavonoid
7-hydroxyflavonoid
Flavan
Chromane
Benzopyran
1-benzopyran
1-hydroxy-2-unsubstituted benzenoid
Alkyl aryl ether
Phenol
Monocyclic benzene moiety
Benzenoid
Monosaccharide
Oxane
Secondary alcohol
Acetal
Ether
Dialkyl ether
Organoheterocyclic compound
Oxacycle
Polyol
Hydrocarbon derivative
Organic oxygen compound
Organooxygen compound
Alcohol
Primary alcohol
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	0.53	ALOGPS
logP	1.15	ChemAxon
logS	-2.8	ALOGPS
pKa (Strongest Acidic)	9.08	ChemAxon
pKa (Strongest Basic)	-3	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	10	ChemAxon
Hydrogen Donor Count	5	ChemAxon
Polar Surface Area	147.3 Å²	ChemAxon
Rotatable Bond Count	4	ChemAxon
Refractivity	117.37 m³·mol⁻¹	ChemAxon
Polarizability	49.65 Å³	ChemAxon
Number of Rings	5	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

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

74081334

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

LOTUS database [Link]

Showing NP-Card for 5-(hydroxymethyl)-12-(4-hydroxyphenyl)-17-(methoxymethyl)-15-methyl-2,4,9,13-tetraoxatetracyclo[8.7.1.0³,⁸.0¹⁴,¹⁸]octadeca-1(18),14,16-triene-6,7,16-triol (NP0328259)

MOL for NP0328259 (5-(hydroxymethyl)-12-(4-hydroxyphenyl)-17-(methoxymethyl)-15-methyl-2,4,9,13-tetraoxatetracyclo[8.7.1.0³,⁸.0¹⁴,¹⁸]octadeca-1(18),14,16-triene-6,7,16-triol)

3D MOL for NP0328259 (5-(hydroxymethyl)-12-(4-hydroxyphenyl)-17-(methoxymethyl)-15-methyl-2,4,9,13-tetraoxatetracyclo[8.7.1.0³,⁸.0¹⁴,¹⁸]octadeca-1(18),14,16-triene-6,7,16-triol)

3D SDF for NP0328259 (5-(hydroxymethyl)-12-(4-hydroxyphenyl)-17-(methoxymethyl)-15-methyl-2,4,9,13-tetraoxatetracyclo[8.7.1.0³,⁸.0¹⁴,¹⁸]octadeca-1(18),14,16-triene-6,7,16-triol)

3D-SDF for NP0328259 (5-(hydroxymethyl)-12-(4-hydroxyphenyl)-17-(methoxymethyl)-15-methyl-2,4,9,13-tetraoxatetracyclo[8.7.1.0³,⁸.0¹⁴,¹⁸]octadeca-1(18),14,16-triene-6,7,16-triol)

PDB for NP0328259 (5-(hydroxymethyl)-12-(4-hydroxyphenyl)-17-(methoxymethyl)-15-methyl-2,4,9,13-tetraoxatetracyclo[8.7.1.0³,⁸.0¹⁴,¹⁸]octadeca-1(18),14,16-triene-6,7,16-triol)

3D PDB for NP0328259 (5-(hydroxymethyl)-12-(4-hydroxyphenyl)-17-(methoxymethyl)-15-methyl-2,4,9,13-tetraoxatetracyclo[8.7.1.0³,⁸.0¹⁴,¹⁸]octadeca-1(18),14,16-triene-6,7,16-triol)

SMILES for NP0328259 (5-(hydroxymethyl)-12-(4-hydroxyphenyl)-17-(methoxymethyl)-15-methyl-2,4,9,13-tetraoxatetracyclo[8.7.1.0³,⁸.0¹⁴,¹⁸]octadeca-1(18),14,16-triene-6,7,16-triol)

INCHI for NP0328259 (5-(hydroxymethyl)-12-(4-hydroxyphenyl)-17-(methoxymethyl)-15-methyl-2,4,9,13-tetraoxatetracyclo[8.7.1.0³,⁸.0¹⁴,¹⁸]octadeca-1(18),14,16-triene-6,7,16-triol)

Structure for NP0328259 (5-(hydroxymethyl)-12-(4-hydroxyphenyl)-17-(methoxymethyl)-15-methyl-2,4,9,13-tetraoxatetracyclo[8.7.1.0³,⁸.0¹⁴,¹⁸]octadeca-1(18),14,16-triene-6,7,16-triol)

3D Structure for NP0328259 (5-(hydroxymethyl)-12-(4-hydroxyphenyl)-17-(methoxymethyl)-15-methyl-2,4,9,13-tetraoxatetracyclo[8.7.1.0³,⁸.0¹⁴,¹⁸]octadeca-1(18),14,16-triene-6,7,16-triol)