NP-MRD: Showing NP-Card for 8a-[(acetyloxy)methyl]-5-{5-ethoxy-hexahydrofuro[2,3-b]furan-2-yl}-5,6-dimethyl-hexahydro-2h-spiro[naphthalene-1,2'-oxiran]-8-yl pyridine-3-carboxylate (NP0154155)

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Record Information

Version

2.0

Created at

2022-09-02 10:55:37 UTC

Updated at

2022-09-02 10:55:38 UTC

NP-MRD ID

NP0154155

Secondary Accession Numbers

None

Natural Product Identification

Common Name

8a-[(acetyloxy)methyl]-5-{5-ethoxy-hexahydrofuro[2,3-b]furan-2-yl}-5,6-dimethyl-hexahydro-2h-spiro[naphthalene-1,2'-oxiran]-8-yl pyridine-3-carboxylate

Description

8A-[(acetyloxy)methyl]-5-{5-ethoxy-hexahydrofuro[2,3-b]furan-2-yl}-5,6-dimethyl-octahydro-2H-spiro[naphthalene-1,2'-oxirane]-8-yl pyridine-3-carboxylate belongs to the class of organic compounds known as pyridinecarboxylic acids. Pyridinecarboxylic acids are compounds containing a pyridine ring bearing a carboxylic acid group. 8a-[(acetyloxy)methyl]-5-{5-ethoxy-hexahydrofuro[2,3-b]furan-2-yl}-5,6-dimethyl-hexahydro-2h-spiro[naphthalene-1,2'-oxiran]-8-yl pyridine-3-carboxylate is found in Scutellaria barbata. 8A-[(acetyloxy)methyl]-5-{5-ethoxy-hexahydrofuro[2,3-b]furan-2-yl}-5,6-dimethyl-octahydro-2H-spiro[naphthalene-1,2'-oxirane]-8-yl pyridine-3-carboxylate is a strong basic compound (based on its pKa).

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1533004151520062D          

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M  END

     RDKit          3D

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M  END


  Mrv1533004151520062D          

 39 44  0  0  0  0            999 V2000
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    1.2472    3.5977    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0532    3.7738    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6087    3.1638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9681   -0.4142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8773    0.4057    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1217    0.7370    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4570    0.2484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7015    0.5796    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0486   -0.4684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5236   -1.0242    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2731   -1.8103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4671   -1.9863    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9116   -1.3764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1622   -0.5903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3761   -0.3398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9861    0.2157    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  1  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
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  6 10  1  0  0  0  0
 10 11  1  0  0  0  0
  4 11  1  0  0  0  0
  8 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 19 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 21 26  1  0  0  0  0
 17 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 30 32  1  0  0  0  0
 27 33  1  0  0  0  0
 12 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 36 37  1  0  0  0  0
 27 37  1  0  0  0  0
 37 38  1  0  0  0  0
 38 39  1  0  0  0  0
 37 39  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0154155

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CCOC1CC2CC(OC2O1)C1(C)C(C)CC(OC(=O)C2=CC=CN=C2)C2(COC(C)=O)C1CCCC21CO1

> <INCHI_IDENTIFIER>
InChI=1S/C30H41NO8/c1-5-34-25-14-21-13-23(38-27(21)39-25)28(4)18(2)12-24(37-26(33)20-8-7-11-31-15-20)30(17-35-19(3)32)22(28)9-6-10-29(30)16-36-29/h7-8,11,15,18,21-25,27H,5-6,9-10,12-14,16-17H2,1-4H3

> <INCHI_KEY>
QKISVSHUNJJKNY-UHFFFAOYSA-N

> <FORMULA>
C30H41NO8

> <MOLECULAR_WEIGHT>
543.657

> <EXACT_MASS>
543.283217284

> <JCHEM_ACCEPTOR_COUNT>
7

> <JCHEM_ATOM_COUNT>
80

> <JCHEM_AVERAGE_POLARIZABILITY>
57.927166988387754

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
8a-[(acetyloxy)methyl]-5-{5-ethoxy-hexahydrofuro[2,3-b]furan-2-yl}-5,6-dimethyl-octahydro-2H-spiro[naphthalene-1,2'-oxirane]-8-yl pyridine-3-carboxylate

> <ALOGPS_LOGP>
3.67

> <JCHEM_LOGP>
3.5036445646666676

> <ALOGPS_LOGS>
-5.12

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
6

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_BASIC>
3.240887618095652

> <JCHEM_POLAR_SURFACE_AREA>
105.71000000000001

> <JCHEM_REFRACTIVITY>
139.39799999999997

> <JCHEM_ROTATABLE_BOND_COUNT>
9

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
4.09e-03 g/l

> <JCHEM_TRADITIONAL_IUPAC>
8a-[(acetyloxy)methyl]-5-{5-ethoxy-hexahydrofuro[2,3-b]furan-2-yl}-5,6-dimethyl-hexahydro-2H-spiro[naphthalene-1,2'-oxirane]-8-yl pyridine-3-carboxylate

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 15-APR-15   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   15-APR-15         0                                  
HETATM    1  C   UNK     0      17.943  -4.258   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      16.416  -4.052   0.000  0.00  0.00           C+0
HETATM    3  O   UNK     0      15.832  -2.628   0.000  0.00  0.00           O+0
HETATM    4  C   UNK     0      14.305  -2.422   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      13.575  -1.066   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      12.060  -1.342   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      10.672  -0.675   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       9.608  -1.789   0.000  0.00  0.00           C+0
HETATM    9  O   UNK     0      10.339  -3.145   0.000  0.00  0.00           O+0
HETATM   10  C   UNK     0      11.854  -2.869   0.000  0.00  0.00           C+0
HETATM   11  O   UNK     0      13.242  -3.536   0.000  0.00  0.00           O+0
HETATM   12  C   UNK     0       8.082  -1.583   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       8.144  -3.122   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       8.550  -0.116   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      10.054   0.213   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       7.513   1.023   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       6.008   0.694   0.000  0.00  0.00           C+0
HETATM   18  O   UNK     0       4.971   1.833   0.000  0.00  0.00           O+0
HETATM   19  C   UNK     0       5.439   3.300   0.000  0.00  0.00           C+0
HETATM   20  O   UNK     0       6.943   3.629   0.000  0.00  0.00           O+0
HETATM   21  C   UNK     0       4.402   4.439   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       2.897   4.110   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0       1.861   5.248   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0       2.328   6.716   0.000  0.00  0.00           C+0
HETATM   25  N   UNK     0       3.833   7.044   0.000  0.00  0.00           N+0
HETATM   26  C   UNK     0       4.870   5.906   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0       5.541  -0.773   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0       5.371   0.757   0.000  0.00  0.00           C+0
HETATM   29  O   UNK     0       3.961   1.376   0.000  0.00  0.00           O+0
HETATM   30  C   UNK     0       2.720   0.464   0.000  0.00  0.00           C+0
HETATM   31  O   UNK     0       1.309   1.082   0.000  0.00  0.00           O+0
HETATM   32  C   UNK     0       1.957  -0.874   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0       6.577  -1.912   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0       6.110  -3.379   0.000  0.00  0.00           C+0
HETATM   35  C   UNK     0       4.605  -3.708   0.000  0.00  0.00           C+0
HETATM   36  C   UNK     0       3.568  -2.569   0.000  0.00  0.00           C+0
HETATM   37  C   UNK     0       4.036  -1.102   0.000  0.00  0.00           C+0
HETATM   38  C   UNK     0       2.569  -0.634   0.000  0.00  0.00           C+0
HETATM   39  O   UNK     0       3.707   0.403   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3                                                       
CONECT    3    2    4                                                       
CONECT    4    3    5   11                                                  
CONECT    5    4    6                                                       
CONECT    6    5    7   10                                                  
CONECT    7    6    8                                                       
CONECT    8    7    9   12                                                  
CONECT    9    8   10                                                       
CONECT   10    9    6   11                                                  
CONECT   11   10    4                                                       
CONECT   12    8   13   14   33                                             
CONECT   13   12                                                            
CONECT   14   12   15   16                                                  
CONECT   15   14                                                            
CONECT   16   14   17                                                       
CONECT   17   16   18   27                                                  
CONECT   18   17   19                                                       
CONECT   19   18   20   21                                                  
CONECT   20   19                                                            
CONECT   21   19   22   26                                                  
CONECT   22   21   23                                                       
CONECT   23   22   24                                                       
CONECT   24   23   25                                                       
CONECT   25   24   26                                                       
CONECT   26   25   21                                                       
CONECT   27   17   28   33   37                                             
CONECT   28   27   29                                                       
CONECT   29   28   30                                                       
CONECT   30   29   31   32                                                  
CONECT   31   30                                                            
CONECT   32   30                                                            
CONECT   33   27   12   34                                                  
CONECT   34   33   35                                                       
CONECT   35   34   36                                                       
CONECT   36   35   37                                                       
CONECT   37   36   27   38   39                                             
CONECT   38   37   39                                                       
CONECT   39   38   37                                                       
MASTER        0    0    0    0    0    0    0    0   39    0   88    0
END

View in JSmol

Synonyms

Value	Source
8a-[(Acetyloxy)methyl]-5-{5-ethoxy-hexahydrofuro[2,3-b]furan-2-yl}-5,6-dimethyl-octahydro-2H-spiro[naphthalene-1,2'-oxirane]-8-yl pyridine-3-carboxylic acid	Generator

Chemical Formula

C₃₀H₄₁NO₈

Average Mass

543.6570 Da

Monoisotopic Mass

543.28322 Da

IUPAC Name

8a-[(acetyloxy)methyl]-5-{5-ethoxy-hexahydrofuro[2,3-b]furan-2-yl}-5,6-dimethyl-octahydro-2H-spiro[naphthalene-1,2'-oxirane]-8-yl pyridine-3-carboxylate

Traditional Name

8a-[(acetyloxy)methyl]-5-{5-ethoxy-hexahydrofuro[2,3-b]furan-2-yl}-5,6-dimethyl-hexahydro-2H-spiro[naphthalene-1,2'-oxirane]-8-yl pyridine-3-carboxylate

CAS Registry Number

Not Available

SMILES

CCOC1CC2CC(OC2O1)C1(C)C(C)CC(OC(=O)C2=CC=CN=C2)C2(COC(C)=O)C1CCCC21CO1

InChI Identifier

InChI=1S/C30H41NO8/c1-5-34-25-14-21-13-23(38-27(21)39-25)28(4)18(2)12-24(37-26(33)20-8-7-11-31-15-20)30(17-35-19(3)32)22(28)9-6-10-29(30)16-36-29/h7-8,11,15,18,21-25,27H,5-6,9-10,12-14,16-17H2,1-4H3

InChI Key

QKISVSHUNJJKNY-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

Species Name	Source	Reference
Scutellaria barbata	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as pyridinecarboxylic acids. Pyridinecarboxylic acids are compounds containing a pyridine ring bearing a carboxylic acid group.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Pyridines and derivatives

Sub Class

Pyridinecarboxylic acids and derivatives

Direct Parent

Pyridinecarboxylic acids

Alternative Parents

Substituents

Pyridine carboxylic acid
Furofuran
Dicarboxylic acid or derivatives
Tetrahydrofuran
Heteroaromatic compound
Carboxylic acid ester
Acetal
Carboxylic acid derivative
Dialkyl ether
Oxirane
Ether
Azacycle
Oxacycle
Organic nitrogen compound
Organopnictogen compound
Organonitrogen compound
Organooxygen compound
Organic oxide
Hydrocarbon derivative
Carbonyl group
Organic oxygen 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	3.67	ALOGPS
logP	3.5	ChemAxon
logS	-5.1	ALOGPS
pKa (Strongest Basic)	3.24	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	7	ChemAxon
Hydrogen Donor Count	0	ChemAxon
Polar Surface Area	105.71 Å²	ChemAxon
Rotatable Bond Count	9	ChemAxon
Refractivity	139.4 m³·mol⁻¹	ChemAxon
Polarizability	57.93 Å³	ChemAxon
Number of Rings	6	ChemAxon
Bioavailability	Yes	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

74323815

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

LOTUS database [Link]

Showing NP-Card for 8a-[(acetyloxy)methyl]-5-{5-ethoxy-hexahydrofuro[2,3-b]furan-2-yl}-5,6-dimethyl-hexahydro-2h-spiro[naphthalene-1,2'-oxiran]-8-yl pyridine-3-carboxylate (NP0154155)

MOL for NP0154155 (8a-[(acetyloxy)methyl]-5-{5-ethoxy-hexahydrofuro[2,3-b]furan-2-yl}-5,6-dimethyl-hexahydro-2h-spiro[naphthalene-1,2'-oxiran]-8-yl pyridine-3-carboxylate)

3D MOL for NP0154155 (8a-[(acetyloxy)methyl]-5-{5-ethoxy-hexahydrofuro[2,3-b]furan-2-yl}-5,6-dimethyl-hexahydro-2h-spiro[naphthalene-1,2'-oxiran]-8-yl pyridine-3-carboxylate)

3D SDF for NP0154155 (8a-[(acetyloxy)methyl]-5-{5-ethoxy-hexahydrofuro[2,3-b]furan-2-yl}-5,6-dimethyl-hexahydro-2h-spiro[naphthalene-1,2'-oxiran]-8-yl pyridine-3-carboxylate)

3D-SDF for NP0154155 (8a-[(acetyloxy)methyl]-5-{5-ethoxy-hexahydrofuro[2,3-b]furan-2-yl}-5,6-dimethyl-hexahydro-2h-spiro[naphthalene-1,2'-oxiran]-8-yl pyridine-3-carboxylate)

PDB for NP0154155 (8a-[(acetyloxy)methyl]-5-{5-ethoxy-hexahydrofuro[2,3-b]furan-2-yl}-5,6-dimethyl-hexahydro-2h-spiro[naphthalene-1,2'-oxiran]-8-yl pyridine-3-carboxylate)

3D PDB for NP0154155 (8a-[(acetyloxy)methyl]-5-{5-ethoxy-hexahydrofuro[2,3-b]furan-2-yl}-5,6-dimethyl-hexahydro-2h-spiro[naphthalene-1,2'-oxiran]-8-yl pyridine-3-carboxylate)

SMILES for NP0154155 (8a-[(acetyloxy)methyl]-5-{5-ethoxy-hexahydrofuro[2,3-b]furan-2-yl}-5,6-dimethyl-hexahydro-2h-spiro[naphthalene-1,2'-oxiran]-8-yl pyridine-3-carboxylate)

INCHI for NP0154155 (8a-[(acetyloxy)methyl]-5-{5-ethoxy-hexahydrofuro[2,3-b]furan-2-yl}-5,6-dimethyl-hexahydro-2h-spiro[naphthalene-1,2'-oxiran]-8-yl pyridine-3-carboxylate)

Structure for NP0154155 (8a-[(acetyloxy)methyl]-5-{5-ethoxy-hexahydrofuro[2,3-b]furan-2-yl}-5,6-dimethyl-hexahydro-2h-spiro[naphthalene-1,2'-oxiran]-8-yl pyridine-3-carboxylate)

3D Structure for NP0154155 (8a-[(acetyloxy)methyl]-5-{5-ethoxy-hexahydrofuro[2,3-b]furan-2-yl}-5,6-dimethyl-hexahydro-2h-spiro[naphthalene-1,2'-oxiran]-8-yl pyridine-3-carboxylate)