NP-MRD: Showing NP-Card for methyl (1'r,2'r,3s,9'r,11'r)-11'-hydroxy-2,2,2',6',9',11'-hexamethyl-13'-methylidene-6,10',12'-trioxospiro[pyran-3,5'-tricyclo[7.3.1.0²,⁷]tridecan]-6'-ene-1'-carboxylate (NP0226907)

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Record Information

Version

2.0

Created at

2022-09-06 06:05:46 UTC

Updated at

2022-09-06 06:05:46 UTC

NP-MRD ID

NP0226907

Secondary Accession Numbers

None

Natural Product Identification

Common Name

methyl (1'r,2'r,3s,9'r,11'r)-11'-hydroxy-2,2,2',6',9',11'-hexamethyl-13'-methylidene-6,10',12'-trioxospiro[pyran-3,5'-tricyclo[7.3.1.0²,⁷]tridecan]-6'-ene-1'-carboxylate

Description

Methyl (1'R,2'R,3S,9'R,11'R)-11'-hydroxy-2,2,2',6',9',11'-hexamethyl-13'-methylidene-6,10',12'-trioxo-2,6-dihydrospiro[pyran-3,5'-tricyclo[7.3.1.0²,⁷]Tridecan]-6'-ene-1'-carboxylate belongs to the class of organic compounds known as dihydropyranones. Dihydropyranones are compounds containing a hydrogenated pyran ring which bears a ketone, and contains one double bond. methyl (1'r,2'r,3s,9'r,11'r)-11'-hydroxy-2,2,2',6',9',11'-hexamethyl-13'-methylidene-6,10',12'-trioxospiro[pyran-3,5'-tricyclo[7.3.1.0²,⁷]tridecan]-6'-ene-1'-carboxylate is found in Melia azedarach. Based on a literature review very few articles have been published on methyl (1'R,2'R,3S,9'R,11'R)-11'-hydroxy-2,2,2',6',9',11'-hexamethyl-13'-methylidene-6,10',12'-trioxo-2,6-dihydrospiro[pyran-3,5'-tricyclo[7.3.1.0²,⁷]Tridecan]-6'-ene-1'-carboxylate.

Structure

MOL SDF PDB SMILES InChI


  Mrv1652309062208052D          

 33 36  0  0  1  0            999 V2000
    0.6667   -0.4571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3867   -0.0544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7815    0.9842    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.8789    1.8034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6371    2.1287    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2181    2.2974    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3155    3.1166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9874    0.7606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4770    1.4088    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5839    0.0410    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.0067    0.6170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1253   -0.3804    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8075   -0.7531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1593   -1.2635    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5271   -1.1566    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.4297   -1.9758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3212   -0.9330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7247   -0.2134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5242   -0.4169    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7478   -1.2110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1002    0.1738    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.6761    0.7644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4757    0.5610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6992   -0.2332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4987   -0.4366    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1232   -0.8238    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3237   -0.6204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0925   -1.4123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5748   -1.4062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8766    0.9679    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0771    1.1714    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5011    0.5807    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.3832    1.3972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  1  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  6  7  1  0  0  0  0
  3  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
 10 11  1  6  0  0  0
 10 12  1  1  0  0  0
 10 13  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
  2 15  1  0  0  0  0
 15 16  1  6  0  0  0
 15 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 21 19  1  6  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 24 26  1  0  0  0  0
 26 27  1  0  0  0  0
 21 27  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
 21 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 18 32  1  0  0  0  0
  3 32  1  0  0  0  0
 32 33  1  1  0  0  0
M  END


  Mrv1652309062208052D          

 33 36  0  0  1  0            999 V2000
    0.6667   -0.4571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3867   -0.0544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7815    0.9842    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.8789    1.8034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6371    2.1287    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2181    2.2974    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3155    3.1166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9874    0.7606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4770    1.4088    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5839    0.0410    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.0067    0.6170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1253   -0.3804    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8075   -0.7531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1593   -1.2635    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5271   -1.1566    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.4297   -1.9758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3212   -0.9330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7247   -0.2134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5242   -0.4169    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7478   -1.2110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1002    0.1738    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.6761    0.7644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4757    0.5610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6992   -0.2332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4987   -0.4366    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1232   -0.8238    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3237   -0.6204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0925   -1.4123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5748   -1.4062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8766    0.9679    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0771    1.1714    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5011    0.5807    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.3832    1.3972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  1  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  6  7  1  0  0  0  0
  3  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
 10 11  1  6  0  0  0
 10 12  1  1  0  0  0
 10 13  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
  2 15  1  0  0  0  0
 15 16  1  6  0  0  0
 15 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 21 19  1  6  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 24 26  1  0  0  0  0
 26 27  1  0  0  0  0
 21 27  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
 21 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 18 32  1  0  0  0  0
  3 32  1  0  0  0  0
 32 33  1  1  0  0  0
M  END
> <DATABASE_ID>
NP0226907

> <DATABASE_NAME>
NP-MRD

> <SMILES>
COC(=O)[C@]12C(=C)[C@@](C)(CC3=C(C)[C@]4(CC[C@@]13C)C=CC(=O)OC4(C)C)C(=O)[C@@](C)(O)C2=O

> <INCHI_IDENTIFIER>
InChI=1S/C26H32O7/c1-14-16-13-22(5)15(2)26(20(30)32-8,19(29)24(7,31)18(22)28)23(16,6)11-12-25(14)10-9-17(27)33-21(25,3)4/h9-10,31H,2,11-13H2,1,3-8H3/t22-,23-,24-,25-,26-/m1/s1

> <INCHI_KEY>
HYHJAMQARBFCBV-ZFXZZAOISA-N

> <FORMULA>
C26H32O7

> <MOLECULAR_WEIGHT>
456.535

> <EXACT_MASS>
456.21480337

> <JCHEM_ACCEPTOR_COUNT>
5

> <JCHEM_ATOM_COUNT>
65

> <JCHEM_AVERAGE_POLARIZABILITY>
49.90966100399385

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
methyl (1'R,2'R,3S,9'R,11'R)-11'-hydroxy-2,2,2',6',9',11'-hexamethyl-13'-methylidene-6,10',12'-trioxo-2,6-dihydrospiro[pyran-3,5'-tricyclo[7.3.1.0^{2,7}]tridecan]-6'-ene-1'-carboxylate

> <JCHEM_LOGP>
3.5995709876666666

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
4

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_ACIDIC>
11.481300458688947

> <JCHEM_PKA_STRONGEST_BASIC>
-4.337879179369453

> <JCHEM_POLAR_SURFACE_AREA>
106.97000000000001

> <JCHEM_REFRACTIVITY>
121.18229999999998

> <JCHEM_ROTATABLE_BOND_COUNT>
2

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
methyl (1'R,2'R,3S,9'R,11'R)-11'-hydroxy-2,2,2',6',9',11'-hexamethyl-13'-methylidene-6,10',12'-trioxospiro[pyran-3,5'-tricyclo[7.3.1.0^{2,7}]tridecan]-6'-ene-1'-carboxylate

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 06-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   06-SEP-22         0                                  
HETATM    1  C   UNK     0       1.245  -0.853   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       2.589  -0.102   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       3.326   1.837   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       3.507   3.366   0.000  0.00  0.00           C+0
HETATM    5  O   UNK     0       4.923   3.974   0.000  0.00  0.00           O+0
HETATM    6  O   UNK     0       2.274   4.288   0.000  0.00  0.00           O+0
HETATM    7  C   UNK     0       2.456   5.818   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       1.843   1.420   0.000  0.00  0.00           C+0
HETATM    9  O   UNK     0       0.890   2.630   0.000  0.00  0.00           O+0
HETATM   10  C   UNK     0       1.090   0.077   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -0.013   1.152   0.000  0.00  0.00           C+0
HETATM   12  O   UNK     0      -0.234  -0.710   0.000  0.00  0.00           O+0
HETATM   13  C   UNK     0       1.507  -1.406   0.000  0.00  0.00           C+0
HETATM   14  O   UNK     0       0.297  -2.359   0.000  0.00  0.00           O+0
HETATM   15  C   UNK     0       2.851  -2.159   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       2.669  -3.688   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       4.333  -1.742   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       5.086  -0.398   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       6.579  -0.778   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       6.996  -2.261   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       7.654   0.324   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       8.729   1.427   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      10.221   1.047   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      10.639  -0.435   0.000  0.00  0.00           C+0
HETATM   25  O   UNK     0      12.131  -0.815   0.000  0.00  0.00           O+0
HETATM   26  O   UNK     0       9.563  -1.538   0.000  0.00  0.00           O+0
HETATM   27  C   UNK     0       8.071  -1.158   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0       7.639  -2.636   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0       8.540  -2.625   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0       7.236   1.807   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0       5.744   2.187   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0       4.669   1.084   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0       4.449   2.608   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3   15                                                  
CONECT    3    2    4    8   32                                             
CONECT    4    3    5    6                                                  
CONECT    5    4                                                            
CONECT    6    4    7                                                       
CONECT    7    6                                                            
CONECT    8    3    9   10                                                  
CONECT    9    8                                                            
CONECT   10    8   11   12   13                                             
CONECT   11   10                                                            
CONECT   12   10                                                            
CONECT   13   10   14   15                                                  
CONECT   14   13                                                            
CONECT   15   13    2   16   17                                             
CONECT   16   15                                                            
CONECT   17   15   18                                                       
CONECT   18   17   19   32                                                  
CONECT   19   18   20   21                                                  
CONECT   20   19                                                            
CONECT   21   19   22   27   30                                             
CONECT   22   21   23                                                       
CONECT   23   22   24                                                       
CONECT   24   23   25   26                                                  
CONECT   25   24                                                            
CONECT   26   24   27                                                       
CONECT   27   26   21   28   29                                             
CONECT   28   27                                                            
CONECT   29   27                                                            
CONECT   30   21   31                                                       
CONECT   31   30   32                                                       
CONECT   32   31   18    3   33                                             
CONECT   33   32                                                            
MASTER        0    0    0    0    0    0    0    0   33    0   72    0
END

View in JSmol

Synonyms

Value	Source
Methyl (1'r,2'r,3S,9'r,11'r)-11'-hydroxy-2,2,2',6',9',11'-hexamethyl-13'-methylidene-6,10',12'-trioxo-2,6-dihydrospiro[pyran-3,5'-tricyclo[7.3.1.0,]tridecan]-6'-ene-1'-carboxylic acid	Generator

Chemical Formula

C₂₆H₃₂O₇

Average Mass

456.5350 Da

Monoisotopic Mass

456.21480 Da

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

COC(=O)[C@]12C(=C)[C@@](C)(CC3=C(C)[C@]4(CC[C@@]13C)C=CC(=O)OC4(C)C)C(=O)[C@@](C)(O)C2=O

InChI Identifier

InChI=1S/C26H32O7/c1-14-16-13-22(5)15(2)26(20(30)32-8,19(29)24(7,31)18(22)28)23(16,6)11-12-25(14)10-9-17(27)33-21(25,3)4/h9-10,31H,2,11-13H2,1,3-8H3/t22-,23-,24-,25-,26-/m1/s1

InChI Key

HYHJAMQARBFCBV-ZFXZZAOISA-N

Experimental Spectra

Not Available

Predicted Spectra

Not Available

Chemical Shift Submissions

Not Available

Species

Species of Origin

Species Name	Source	Reference
Melia azedarach	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as dihydropyranones. Dihydropyranones are compounds containing a hydrogenated pyran ring which bears a ketone, and contains one double bond.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Pyrans

Sub Class

Pyranones and derivatives

Direct Parent

Dihydropyranones

Alternative Parents

Substituents

Dihydropyranone
Acyloin
Dicarboxylic acid or derivatives
Cyclic alcohol
Alpha,beta-unsaturated carboxylic ester
Enoate ester
Methyl ester
Tertiary alcohol
Carboxylic acid ester
Ketone
Lactone
Oxacycle
Carboxylic acid derivative
Hydrocarbon derivative
Organic oxide
Organic oxygen compound
Carbonyl group
Alcohol
Organooxygen compound
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

External Links

HMDB ID

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DrugBank ID

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Phenol Explorer Compound ID

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FoodDB ID

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KNApSAcK ID

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Chemspider ID

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KEGG Compound ID

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BioCyc ID

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BiGG ID

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Wikipedia Link

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METLIN ID

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PubChem Compound

162843613

PDB ID

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ChEBI ID

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Good Scents ID

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References

General References

LOTUS database [Link]

Showing NP-Card for methyl (1'r,2'r,3s,9'r,11'r)-11'-hydroxy-2,2,2',6',9',11'-hexamethyl-13'-methylidene-6,10',12'-trioxospiro[pyran-3,5'-tricyclo[7.3.1.0²,⁷]tridecan]-6'-ene-1'-carboxylate (NP0226907)

MOL for NP0226907 (methyl (1'r,2'r,3s,9'r,11'r)-11'-hydroxy-2,2,2',6',9',11'-hexamethyl-13'-methylidene-6,10',12'-trioxospiro[pyran-3,5'-tricyclo[7.3.1.0²,⁷]tridecan]-6'-ene-1'-carboxylate)

3D MOL for NP0226907 (methyl (1'r,2'r,3s,9'r,11'r)-11'-hydroxy-2,2,2',6',9',11'-hexamethyl-13'-methylidene-6,10',12'-trioxospiro[pyran-3,5'-tricyclo[7.3.1.0²,⁷]tridecan]-6'-ene-1'-carboxylate)

3D SDF for NP0226907 (methyl (1'r,2'r,3s,9'r,11'r)-11'-hydroxy-2,2,2',6',9',11'-hexamethyl-13'-methylidene-6,10',12'-trioxospiro[pyran-3,5'-tricyclo[7.3.1.0²,⁷]tridecan]-6'-ene-1'-carboxylate)

3D-SDF for NP0226907 (methyl (1'r,2'r,3s,9'r,11'r)-11'-hydroxy-2,2,2',6',9',11'-hexamethyl-13'-methylidene-6,10',12'-trioxospiro[pyran-3,5'-tricyclo[7.3.1.0²,⁷]tridecan]-6'-ene-1'-carboxylate)

PDB for NP0226907 (methyl (1'r,2'r,3s,9'r,11'r)-11'-hydroxy-2,2,2',6',9',11'-hexamethyl-13'-methylidene-6,10',12'-trioxospiro[pyran-3,5'-tricyclo[7.3.1.0²,⁷]tridecan]-6'-ene-1'-carboxylate)

3D PDB for NP0226907 (methyl (1'r,2'r,3s,9'r,11'r)-11'-hydroxy-2,2,2',6',9',11'-hexamethyl-13'-methylidene-6,10',12'-trioxospiro[pyran-3,5'-tricyclo[7.3.1.0²,⁷]tridecan]-6'-ene-1'-carboxylate)

SMILES for NP0226907 (methyl (1'r,2'r,3s,9'r,11'r)-11'-hydroxy-2,2,2',6',9',11'-hexamethyl-13'-methylidene-6,10',12'-trioxospiro[pyran-3,5'-tricyclo[7.3.1.0²,⁷]tridecan]-6'-ene-1'-carboxylate)

INCHI for NP0226907 (methyl (1'r,2'r,3s,9'r,11'r)-11'-hydroxy-2,2,2',6',9',11'-hexamethyl-13'-methylidene-6,10',12'-trioxospiro[pyran-3,5'-tricyclo[7.3.1.0²,⁷]tridecan]-6'-ene-1'-carboxylate)

Structure for NP0226907 (methyl (1'r,2'r,3s,9'r,11'r)-11'-hydroxy-2,2,2',6',9',11'-hexamethyl-13'-methylidene-6,10',12'-trioxospiro[pyran-3,5'-tricyclo[7.3.1.0²,⁷]tridecan]-6'-ene-1'-carboxylate)

3D Structure for NP0226907 (methyl (1'r,2'r,3s,9'r,11'r)-11'-hydroxy-2,2,2',6',9',11'-hexamethyl-13'-methylidene-6,10',12'-trioxospiro[pyran-3,5'-tricyclo[7.3.1.0²,⁷]tridecan]-6'-ene-1'-carboxylate)