NP-MRD: Showing NP-Card for 6,16,24-trihydroxy-1-(5-hydroxy-6,14-dimethyl-2,8,11-trioxo-1,7-dioxacyclotetradec-3-en-9-yl)-5,11,19,25-tetramethyl-4,10,20,26-tetraoxatricyclo[14.11.1.0²,¹⁵]octacosa-7,22-diene-3,9,14,21,27,28-hexone (NP0161814)

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Record Information

Version

2.0

Created at

2022-09-02 20:04:45 UTC

Updated at

2022-09-02 20:04:46 UTC

NP-MRD ID

NP0161814

Secondary Accession Numbers

None

Natural Product Identification

Common Name

6,16,24-trihydroxy-1-(5-hydroxy-6,14-dimethyl-2,8,11-trioxo-1,7-dioxacyclotetradec-3-en-9-yl)-5,11,19,25-tetramethyl-4,10,20,26-tetraoxatricyclo[14.11.1.0²,¹⁵]octacosa-7,22-diene-3,9,14,21,27,28-hexone

Description

6,16,24-Trihydroxy-1-(5-hydroxy-6,14-dimethyl-2,8,11-trioxo-1,7-dioxacyclotetradec-3-en-9-yl)-5,11,19,25-tetramethyl-4,10,20,26-tetraoxatricyclo[14.11.1.0²,¹⁵]Octacosa-7,22-diene-3,9,14,21,27,28-hexone belongs to the class of organic compounds known as hexacarboxylic acids and derivatives. These are carboxylic acids containing exactly six carboxyl groups. Based on a literature review very few articles have been published on 6,16,24-trihydroxy-1-(5-hydroxy-6,14-dimethyl-2,8,11-trioxo-1,7-dioxacyclotetradec-3-en-9-yl)-5,11,19,25-tetramethyl-4,10,20,26-tetraoxatricyclo[14.11.1.0²,¹⁵]Octacosa-7,22-diene-3,9,14,21,27,28-hexone.

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1652309022222042D          

 61 64  0  0  0  0            999 V2000
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  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
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  9 10  1  0  0  0  0
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M  END

     RDKit          3D

115118  0  0  0  0  0  0  0  0999 V2000
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M  END


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M  END
> <DATABASE_ID>
NP0161814

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CC1CCC(=O)CC(C(=O)OC(C)C(O)C=CC(=O)O1)C12C3C(C(=O)CCC(C)OC(=O)C=CC(O)C(C)OC3=O)C(O)(CCC(C)OC(=O)C=CC(O)C(C)OC1=O)C2=O

> <INCHI_IDENTIFIER>
InChI=1S/C42H54O19/c1-20-7-9-26(43)19-27(37(51)59-23(4)28(44)11-14-32(48)56-20)42-36-35(31(47)10-8-21(2)57-33(49)15-12-29(45)24(5)60-38(36)52)41(55,39(42)53)18-17-22(3)58-34(50)16-13-30(46)25(6)61-40(42)54/h11-16,20-25,27-30,35-36,44-46,55H,7-10,17-19H2,1-6H3

> <INCHI_KEY>
PIKVVAVNSRXTER-UHFFFAOYSA-N

> <FORMULA>
C42H54O19

> <MOLECULAR_WEIGHT>
862.875

> <EXACT_MASS>
862.325929519

> <JCHEM_ACCEPTOR_COUNT>
13

> <JCHEM_ATOM_COUNT>
115

> <JCHEM_AVERAGE_POLARIZABILITY>
84.60081957412837

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
4

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
6,16,24-trihydroxy-1-(5-hydroxy-6,14-dimethyl-2,8,11-trioxo-1,7-dioxacyclotetradec-3-en-9-yl)-5,11,19,25-tetramethyl-4,10,20,26-tetraoxatricyclo[14.11.1.0^{2,15}]octacosa-7,22-diene-3,9,14,21,27,28-hexone

> <ALOGPS_LOGP>
0.93

> <JCHEM_LOGP>
2.1072760506666675

> <ALOGPS_LOGS>
-3.17

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
4

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
12.292055808898454

> <JCHEM_PKA_STRONGEST_ACIDIC>
10.134132376349754

> <JCHEM_PKA_STRONGEST_BASIC>
-3.3459158799239965

> <JCHEM_POLAR_SURFACE_AREA>
289.92999999999995

> <JCHEM_REFRACTIVITY>
208.21270000000007

> <JCHEM_ROTATABLE_BOND_COUNT>
1

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
5.80e-01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
6,16,24-trihydroxy-1-(5-hydroxy-6,14-dimethyl-2,8,11-trioxo-1,7-dioxacyclotetradec-3-en-9-yl)-5,11,19,25-tetramethyl-4,10,20,26-tetraoxatricyclo[14.11.1.0^{2,15}]octacosa-7,22-diene-3,9,14,21,27,28-hexone

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 02-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   02-SEP-22         0                                  
HETATM    1  C   UNK     0       7.200  -2.330   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       7.836  -0.928   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       9.369  -0.778   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      10.265  -2.031   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       9.628  -3.433   0.000  0.00  0.00           C+0
HETATM    6  O   UNK     0      10.524  -4.685   0.000  0.00  0.00           O+0
HETATM    7  C   UNK     0       8.096  -3.583   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       7.459  -4.985   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       8.355  -6.237   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       9.269  -4.998   0.000  0.00  0.00           C+0
HETATM   11  O   UNK     0       8.653  -3.587   0.000  0.00  0.00           O+0
HETATM   12  O   UNK     0      10.799  -5.170   0.000  0.00  0.00           O+0
HETATM   13  C   UNK     0      11.713  -3.931   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      11.097  -2.519   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      13.244  -4.103   0.000  0.00  0.00           C+0
HETATM   16  O   UNK     0      14.158  -2.863   0.000  0.00  0.00           O+0
HETATM   17  C   UNK     0      13.860  -5.514   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      12.946  -6.753   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      13.562  -8.164   0.000  0.00  0.00           C+0
HETATM   20  O   UNK     0      15.093  -8.336   0.000  0.00  0.00           O+0
HETATM   21  O   UNK     0      12.648  -9.404   0.000  0.00  0.00           O+0
HETATM   22  C   UNK     0      11.118  -9.232   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      11.012  -7.413   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      10.204 -10.471   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0       8.674 -10.299   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0       8.057  -8.888   0.000  0.00  0.00           C+0
HETATM   27  O   UNK     0       6.961  -9.969   0.000  0.00  0.00           O+0
HETATM   28  C   UNK     0       8.971  -7.649   0.000  0.00  0.00           C+0
HETATM   29  O   UNK     0      10.502  -7.821   0.000  0.00  0.00           O+0
HETATM   30  C   UNK     0       6.655  -8.252   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0       5.244  -8.868   0.000  0.00  0.00           C+0
HETATM   32  O   UNK     0       4.004  -7.954   0.000  0.00  0.00           O+0
HETATM   33  C   UNK     0       5.072 -10.398   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0       3.660 -11.015   0.000  0.00  0.00           C+0
HETATM   35  C   UNK     0       2.421 -10.101   0.000  0.00  0.00           C+0
HETATM   36  C   UNK     0       1.010 -10.717   0.000  0.00  0.00           C+0
HETATM   37  O   UNK     0       2.593  -8.570   0.000  0.00  0.00           O+0
HETATM   38  C   UNK     0       1.353  -7.656   0.000  0.00  0.00           C+0
HETATM   39  O   UNK     0      -0.058  -8.273   0.000  0.00  0.00           O+0
HETATM   40  C   UNK     0       1.525  -6.126   0.000  0.00  0.00           C+0
HETATM   41  C   UNK     0       3.208  -5.850   0.000  0.00  0.00           C+0
HETATM   42  C   UNK     0       2.973  -3.809   0.000  0.00  0.00           C+0
HETATM   43  O   UNK     0       1.869  -3.065   0.000  0.00  0.00           O+0
HETATM   44  C   UNK     0       4.520  -3.363   0.000  0.00  0.00           C+0
HETATM   45  C   UNK     0       4.692  -1.833   0.000  0.00  0.00           C+0
HETATM   46  O   UNK     0       5.759  -4.277   0.000  0.00  0.00           O+0
HETATM   47  C   UNK     0       5.587  -5.807   0.000  0.00  0.00           C+0
HETATM   48  O   UNK     0       4.176  -6.424   0.000  0.00  0.00           O+0
HETATM   49  C   UNK     0       6.827  -6.721   0.000  0.00  0.00           C+0
HETATM   50  C   UNK     0       5.926  -5.135   0.000  0.00  0.00           C+0
HETATM   51  O   UNK     0       5.290  -6.537   0.000  0.00  0.00           O+0
HETATM   52  O   UNK     0       5.030  -3.882   0.000  0.00  0.00           O+0
HETATM   53  C   UNK     0       3.497  -4.032   0.000  0.00  0.00           C+0
HETATM   54  C   UNK     0       2.861  -5.434   0.000  0.00  0.00           C+0
HETATM   55  C   UNK     0       2.601  -2.780   0.000  0.00  0.00           C+0
HETATM   56  O   UNK     0       1.069  -2.929   0.000  0.00  0.00           O+0
HETATM   57  C   UNK     0       3.238  -1.377   0.000  0.00  0.00           C+0
HETATM   58  C   UNK     0       4.771  -1.228   0.000  0.00  0.00           C+0
HETATM   59  C   UNK     0       5.407   0.175   0.000  0.00  0.00           C+0
HETATM   60  O   UNK     0       4.511   1.427   0.000  0.00  0.00           O+0
HETATM   61  O   UNK     0       6.940   0.324   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3   61                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5                                                       
CONECT    5    4    6    7                                                  
CONECT    6    5                                                            
CONECT    7    5    8                                                       
CONECT    8    7    9   50                                                  
CONECT    9    8   10   28   49                                             
CONECT   10    9   11   12                                                  
CONECT   11   10                                                            
CONECT   12   10   13                                                       
CONECT   13   12   14   15                                                  
CONECT   14   13                                                            
CONECT   15   13   16   17                                                  
CONECT   16   15                                                            
CONECT   17   15   18                                                       
CONECT   18   17   19                                                       
CONECT   19   18   20   21                                                  
CONECT   20   19                                                            
CONECT   21   19   22                                                       
CONECT   22   21   23   24                                                  
CONECT   23   22                                                            
CONECT   24   22   25                                                       
CONECT   25   24   26                                                       
CONECT   26   25   27   28   30                                             
CONECT   27   26                                                            
CONECT   28   26    9   29                                                  
CONECT   29   28                                                            
CONECT   30   26   31   49                                                  
CONECT   31   30   32   33                                                  
CONECT   32   31                                                            
CONECT   33   31   34                                                       
CONECT   34   33   35                                                       
CONECT   35   34   36   37                                                  
CONECT   36   35                                                            
CONECT   37   35   38                                                       
CONECT   38   37   39   40                                                  
CONECT   39   38                                                            
CONECT   40   38   41                                                       
CONECT   41   40   42                                                       
CONECT   42   41   43   44                                                  
CONECT   43   42                                                            
CONECT   44   42   45   46                                                  
CONECT   45   44                                                            
CONECT   46   44   47                                                       
CONECT   47   46   48   49                                                  
CONECT   48   47                                                            
CONECT   49   47   30    9                                                  
CONECT   50    8   51   52                                                  
CONECT   51   50                                                            
CONECT   52   50   53                                                       
CONECT   53   52   54   55                                                  
CONECT   54   53                                                            
CONECT   55   53   56   57                                                  
CONECT   56   55                                                            
CONECT   57   55   58                                                       
CONECT   58   57   59                                                       
CONECT   59   58   60   61                                                  
CONECT   60   59                                                            
CONECT   61   59    2                                                       
MASTER        0    0    0    0    0    0    0    0   61    0  128    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₄₂H₅₄O₁₉

Average Mass

862.8750 Da

Monoisotopic Mass

862.32593 Da

IUPAC Name

Traditional Name

CAS Registry Number

Not Available

SMILES

CC1CCC(=O)CC(C(=O)OC(C)C(O)C=CC(=O)O1)C12C3C(C(=O)CCC(C)OC(=O)C=CC(O)C(C)OC3=O)C(O)(CCC(C)OC(=O)C=CC(O)C(C)OC1=O)C2=O

InChI Identifier

InChI=1S/C42H54O19/c1-20-7-9-26(43)19-27(37(51)59-23(4)28(44)11-14-32(48)56-20)42-36-35(31(47)10-8-21(2)57-33(49)15-12-29(45)24(5)60-38(36)52)41(55,39(42)53)18-17-22(3)58-34(50)16-13-30(46)25(6)61-40(42)54/h11-16,20-25,27-30,35-36,44-46,55H,7-10,17-19H2,1-6H3

InChI Key

PIKVVAVNSRXTER-UHFFFAOYSA-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

Not Available

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as hexacarboxylic acids and derivatives. These are carboxylic acids containing exactly six carboxyl groups.

Kingdom

Organic compounds

Super Class

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Sub Class

Hexacarboxylic acids and derivatives

Direct Parent

Hexacarboxylic acids and derivatives

Alternative Parents

Substituents

Hexacarboxylic acid or derivatives
Macrolide
Alpha,beta-unsaturated carboxylic ester
Enoate ester
Tertiary alcohol
Cyclic alcohol
Cyclic ketone
Secondary alcohol
Lactone
Ketone
Carboxylic acid ester
Oxacycle
Organoheterocyclic compound
Polyol
Organic oxygen compound
Organic oxide
Hydrocarbon derivative
Organooxygen compound
Carbonyl group
Alcohol
Aliphatic heteropolycyclic compound

Molecular Framework

Aliphatic 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	0.93	ALOGPS
logP	2.11	ChemAxon
logS	-3.2	ALOGPS
pKa (Strongest Acidic)	10.13	ChemAxon
pKa (Strongest Basic)	-3.3	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	13	ChemAxon
Hydrogen Donor Count	4	ChemAxon
Polar Surface Area	289.93 Å²	ChemAxon
Rotatable Bond Count	1	ChemAxon
Refractivity	208.21 m³·mol⁻¹	ChemAxon
Polarizability	84.6 Å³	ChemAxon
Number of Rings	4	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	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

162814894

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

LOTUS database [Link]

Showing NP-Card for 6,16,24-trihydroxy-1-(5-hydroxy-6,14-dimethyl-2,8,11-trioxo-1,7-dioxacyclotetradec-3-en-9-yl)-5,11,19,25-tetramethyl-4,10,20,26-tetraoxatricyclo[14.11.1.0²,¹⁵]octacosa-7,22-diene-3,9,14,21,27,28-hexone (NP0161814)

MOL for NP0161814 (6,16,24-trihydroxy-1-(5-hydroxy-6,14-dimethyl-2,8,11-trioxo-1,7-dioxacyclotetradec-3-en-9-yl)-5,11,19,25-tetramethyl-4,10,20,26-tetraoxatricyclo[14.11.1.0²,¹⁵]octacosa-7,22-diene-3,9,14,21,27,28-hexone)

3D MOL for NP0161814 (6,16,24-trihydroxy-1-(5-hydroxy-6,14-dimethyl-2,8,11-trioxo-1,7-dioxacyclotetradec-3-en-9-yl)-5,11,19,25-tetramethyl-4,10,20,26-tetraoxatricyclo[14.11.1.0²,¹⁵]octacosa-7,22-diene-3,9,14,21,27,28-hexone)

3D SDF for NP0161814 (6,16,24-trihydroxy-1-(5-hydroxy-6,14-dimethyl-2,8,11-trioxo-1,7-dioxacyclotetradec-3-en-9-yl)-5,11,19,25-tetramethyl-4,10,20,26-tetraoxatricyclo[14.11.1.0²,¹⁵]octacosa-7,22-diene-3,9,14,21,27,28-hexone)

3D-SDF for NP0161814 (6,16,24-trihydroxy-1-(5-hydroxy-6,14-dimethyl-2,8,11-trioxo-1,7-dioxacyclotetradec-3-en-9-yl)-5,11,19,25-tetramethyl-4,10,20,26-tetraoxatricyclo[14.11.1.0²,¹⁵]octacosa-7,22-diene-3,9,14,21,27,28-hexone)

PDB for NP0161814 (6,16,24-trihydroxy-1-(5-hydroxy-6,14-dimethyl-2,8,11-trioxo-1,7-dioxacyclotetradec-3-en-9-yl)-5,11,19,25-tetramethyl-4,10,20,26-tetraoxatricyclo[14.11.1.0²,¹⁵]octacosa-7,22-diene-3,9,14,21,27,28-hexone)

3D PDB for NP0161814 (6,16,24-trihydroxy-1-(5-hydroxy-6,14-dimethyl-2,8,11-trioxo-1,7-dioxacyclotetradec-3-en-9-yl)-5,11,19,25-tetramethyl-4,10,20,26-tetraoxatricyclo[14.11.1.0²,¹⁵]octacosa-7,22-diene-3,9,14,21,27,28-hexone)

SMILES for NP0161814 (6,16,24-trihydroxy-1-(5-hydroxy-6,14-dimethyl-2,8,11-trioxo-1,7-dioxacyclotetradec-3-en-9-yl)-5,11,19,25-tetramethyl-4,10,20,26-tetraoxatricyclo[14.11.1.0²,¹⁵]octacosa-7,22-diene-3,9,14,21,27,28-hexone)

INCHI for NP0161814 (6,16,24-trihydroxy-1-(5-hydroxy-6,14-dimethyl-2,8,11-trioxo-1,7-dioxacyclotetradec-3-en-9-yl)-5,11,19,25-tetramethyl-4,10,20,26-tetraoxatricyclo[14.11.1.0²,¹⁵]octacosa-7,22-diene-3,9,14,21,27,28-hexone)

Structure for NP0161814 (6,16,24-trihydroxy-1-(5-hydroxy-6,14-dimethyl-2,8,11-trioxo-1,7-dioxacyclotetradec-3-en-9-yl)-5,11,19,25-tetramethyl-4,10,20,26-tetraoxatricyclo[14.11.1.0²,¹⁵]octacosa-7,22-diene-3,9,14,21,27,28-hexone)

3D Structure for NP0161814 (6,16,24-trihydroxy-1-(5-hydroxy-6,14-dimethyl-2,8,11-trioxo-1,7-dioxacyclotetradec-3-en-9-yl)-5,11,19,25-tetramethyl-4,10,20,26-tetraoxatricyclo[14.11.1.0²,¹⁵]octacosa-7,22-diene-3,9,14,21,27,28-hexone)