NP-MRD: Showing NP-Card for 5-hydroxy-2,6,6,9-tetramethyl-4-[(2-methylbut-2-enoyl)oxy]-11-oxotricyclo[5.4.0.0²,⁸]undec-9-en-3-yl 2-methylbut-2-enoate (NP0175843)

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Record Information

Version

2.0

Created at

2022-09-03 13:24:33 UTC

Updated at

2022-09-03 13:24:33 UTC

NP-MRD ID

NP0175843

Secondary Accession Numbers

None

Natural Product Identification

Common Name

5-hydroxy-2,6,6,9-tetramethyl-4-[(2-methylbut-2-enoyl)oxy]-11-oxotricyclo[5.4.0.0²,⁸]undec-9-en-3-yl 2-methylbut-2-enoate

Description

5-Hydroxy-2,6,6,9-tetramethyl-4-[(2-methylbut-2-enoyl)oxy]-11-oxotricyclo[5.4.0.0²,⁸]Undec-9-en-3-yl 2-methylbut-2-enoate belongs to the class of organic compounds known as bicyclic monoterpenoids. These are monoterpenoids containing exactly 2 rings, which are fused to each other. 5-hydroxy-2,6,6,9-tetramethyl-4-[(2-methylbut-2-enoyl)oxy]-11-oxotricyclo[5.4.0.0²,⁸]undec-9-en-3-yl 2-methylbut-2-enoate is found in Palafoxia texana and Stevia connata. 5-Hydroxy-2,6,6,9-tetramethyl-4-[(2-methylbut-2-enoyl)oxy]-11-oxotricyclo[5.4.0.0²,⁸]Undec-9-en-3-yl 2-methylbut-2-enoate is an extremely weak basic (essentially neutral) compound (based on its pKa).

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1533004171522562D          

 31 33  0  0  0  0            999 V2000
    3.7470   -3.1406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2042   -2.5193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4708   -1.7386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2802   -1.5791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9280   -1.1173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1946   -0.3366    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1185   -1.2768    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5757   -0.6555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9345    0.1132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7595    0.1191    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5581    0.8905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5094    1.7141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3564    1.0986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6894    1.0101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0513    0.6888    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5523    0.0008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0570   -0.6826    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8004   -0.4337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3770   -1.0237    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0300    0.2945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2266   -0.1103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5438   -0.4055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7513   -0.9125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4725   -1.6890    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0055   -2.3186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8174   -2.1718    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7267   -3.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2598   -3.7248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0716   -3.5780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0851   -3.2419    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3773    0.0018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  4  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  3  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
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
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  8 23  1  0  0  0  0
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 28 29  1  4  0  0  0
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 16 31  1  0  0  0  0
M  END

     RDKit          3D

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   -0.7705   -2.9126    0.2817 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.7862   -1.9474    0.8309 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.1221   -2.6281    0.6304 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0204   -2.6437    1.4788 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.6331   -3.1342    0.1981 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1035   -3.3889    2.7900 H   0  0  0  0  0  0  0  0  0  0  0  0
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  1 32  1  0
  1 33  1  0
  1 34  1  0
M  END


  Mrv1533004171522562D          

 31 33  0  0  0  0            999 V2000
    3.7470   -3.1406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2042   -2.5193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4708   -1.7386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2802   -1.5791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9280   -1.1173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1946   -0.3366    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    0.4725   -1.6890    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
> <DATABASE_ID>
NP0175843

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CC=C(C)C(=O)OC1C(O)C(C)(C)C2C3C(C)=CC(=O)C2C3(C)C1OC(=O)C(C)=CC

> <INCHI_IDENTIFIER>
InChI=1S/C25H34O6/c1-9-12(3)22(28)30-19-20(27)24(6,7)18-16-14(5)11-15(26)17(18)25(16,8)21(19)31-23(29)13(4)10-2/h9-11,16-21,27H,1-8H3

> <INCHI_KEY>
CGWWCZUCMNTYRU-UHFFFAOYSA-N

> <FORMULA>
C25H34O6

> <MOLECULAR_WEIGHT>
430.541

> <EXACT_MASS>
430.235538815

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_ATOM_COUNT>
65

> <JCHEM_AVERAGE_POLARIZABILITY>
46.712932215986584

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
5-hydroxy-2,6,6,9-tetramethyl-4-[(2-methylbut-2-enoyl)oxy]-11-oxotricyclo[5.4.0.0²,⁸]undec-9-en-3-yl 2-methylbut-2-enoate

> <ALOGPS_LOGP>
3.86

> <JCHEM_LOGP>
4.738816437666665

> <ALOGPS_LOGS>
-4.33

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
17.35886501847809

> <JCHEM_PKA_STRONGEST_ACIDIC>
13.651417994740306

> <JCHEM_PKA_STRONGEST_BASIC>
-3.3885738125515275

> <JCHEM_POLAR_SURFACE_AREA>
89.9

> <JCHEM_REFRACTIVITY>
118.0825

> <JCHEM_ROTATABLE_BOND_COUNT>
6

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
2.00e-02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
5-hydroxy-2,6,6,9-tetramethyl-4-[(2-methylbut-2-enoyl)oxy]-11-oxotricyclo[5.4.0.0²,⁸]undec-9-en-3-yl 2-methylbut-2-enoate

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 17-APR-15   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   17-APR-15         0                                  
HETATM    1  C   UNK     0       6.994  -5.862   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       5.981  -4.703   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       6.479  -3.245   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       7.990  -2.948   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       5.466  -2.086   0.000  0.00  0.00           C+0
HETATM    6  O   UNK     0       5.963  -0.628   0.000  0.00  0.00           O+0
HETATM    7  O   UNK     0       3.955  -2.383   0.000  0.00  0.00           O+0
HETATM    8  C   UNK     0       2.941  -1.224   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       3.611   0.211   0.000  0.00  0.00           C+0
HETATM   10  O   UNK     0       5.151   0.222   0.000  0.00  0.00           O+0
HETATM   11  C   UNK     0       2.909   1.662   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       2.818   3.200   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       4.399   2.051   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       1.287   1.886   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      -0.096   1.286   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      -1.031   0.002   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      -0.106  -1.274   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       1.494  -0.810   0.000  0.00  0.00           C+0
HETATM   19  O   UNK     0       2.570  -1.911   0.000  0.00  0.00           O+0
HETATM   20  C   UNK     0       1.923   0.550   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       0.423  -0.206   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      -1.015  -0.757   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0       1.402  -1.703   0.000  0.00  0.00           C+0
HETATM   24  O   UNK     0       0.882  -3.153   0.000  0.00  0.00           O+0
HETATM   25  C   UNK     0       1.877  -4.328   0.000  0.00  0.00           C+0
HETATM   26  O   UNK     0       3.392  -4.054   0.000  0.00  0.00           O+0
HETATM   27  C   UNK     0       1.357  -5.778   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0       2.352  -6.953   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0       3.867  -6.679   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0      -0.159  -6.052   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0      -2.571   0.003   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3                                                       
CONECT    3    2    4    5                                                  
CONECT    4    3                                                            
CONECT    5    3    6    7                                                  
CONECT    6    5                                                            
CONECT    7    5    8                                                       
CONECT    8    7    9   23                                                  
CONECT    9    8   10   11                                                  
CONECT   10    9                                                            
CONECT   11    9   12   13   14                                             
CONECT   12   11                                                            
CONECT   13   11                                                            
CONECT   14   11   15   20                                                  
CONECT   15   14   16   21                                                  
CONECT   16   15   17   31                                                  
CONECT   17   16   18                                                       
CONECT   18   17   19   20                                                  
CONECT   19   18                                                            
CONECT   20   18   14   21                                                  
CONECT   21   20   15   22   23                                             
CONECT   22   21                                                            
CONECT   23   21    8   24                                                  
CONECT   24   23   25                                                       
CONECT   25   24   26   27                                                  
CONECT   26   25                                                            
CONECT   27   25   28   30                                                  
CONECT   28   27   29                                                       
CONECT   29   28                                                            
CONECT   30   27                                                            
CONECT   31   16                                                            
MASTER        0    0    0    0    0    0    0    0   31    0   66    0
END

View in JSmol

Synonyms

Value	Source
5-Hydroxy-2,6,6,9-tetramethyl-4-[(2-methylbut-2-enoyl)oxy]-11-oxotricyclo[5.4.0.0,]undec-9-en-3-yl 2-methylbut-2-enoic acid	Generator
5-Hydroxy-2,6,6,9-tetramethyl-4-[(2-methylbut-2-enoyl)oxy]-11-oxotricyclo[5.4.0.0²,⁸]undec-9-en-3-yl 2-methylbut-2-enoic acid	Generator

Chemical Formula

C₂₅H₃₄O₆

Average Mass

430.5410 Da

Monoisotopic Mass

430.23554 Da

IUPAC Name

5-hydroxy-2,6,6,9-tetramethyl-4-[(2-methylbut-2-enoyl)oxy]-11-oxotricyclo[5.4.0.0²,⁸]undec-9-en-3-yl 2-methylbut-2-enoate

Traditional Name

5-hydroxy-2,6,6,9-tetramethyl-4-[(2-methylbut-2-enoyl)oxy]-11-oxotricyclo[5.4.0.0²,⁸]undec-9-en-3-yl 2-methylbut-2-enoate

CAS Registry Number

Not Available

SMILES

CC=C(C)C(=O)OC1C(O)C(C)(C)C2C3C(C)=CC(=O)C2C3(C)C1OC(=O)C(C)=CC

InChI Identifier

InChI=1S/C25H34O6/c1-9-12(3)22(28)30-19-20(27)24(6,7)18-16-14(5)11-15(26)17(18)25(16,8)21(19)31-23(29)13(4)10-2/h9-11,16-21,27H,1-8H3

InChI Key

CGWWCZUCMNTYRU-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
Palafoxia texana	LOTUS Database	35616633
Stevia connata	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as bicyclic monoterpenoids. These are monoterpenoids containing exactly 2 rings, which are fused to each other.

Kingdom

Organic compounds

Super Class

Lipids and lipid-like molecules

Class

Prenol lipids

Sub Class

Monoterpenoids

Direct Parent

Bicyclic monoterpenoids

Alternative Parents

Substituents

Pinane monoterpenoid
Cyclohexenone
Fatty acid ester
Cyclitol or derivatives
Fatty acyl
Dicarboxylic acid or derivatives
Cyclic alcohol
Alpha,beta-unsaturated carboxylic ester
Enoate ester
Carboxylic acid ester
Secondary alcohol
Ketone
Carboxylic acid derivative
Hydrocarbon derivative
Alcohol
Carbonyl group
Organic oxide
Organooxygen compound
Organic oxygen compound
Aliphatic homopolycyclic compound

Molecular Framework

Aliphatic homopolycyclic 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	3.86	ALOGPS
logP	4.74	ChemAxon
logS	-4.3	ALOGPS
pKa (Strongest Acidic)	13.65	ChemAxon
pKa (Strongest Basic)	-3.4	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	4	ChemAxon
Hydrogen Donor Count	1	ChemAxon
Polar Surface Area	89.9 Å²	ChemAxon
Rotatable Bond Count	6	ChemAxon
Refractivity	118.08 m³·mol⁻¹	ChemAxon
Polarizability	46.71 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	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

432000

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

LOTUS database [Link]

Showing NP-Card for 5-hydroxy-2,6,6,9-tetramethyl-4-[(2-methylbut-2-enoyl)oxy]-11-oxotricyclo[5.4.0.0²,⁸]undec-9-en-3-yl 2-methylbut-2-enoate (NP0175843)

MOL for NP0175843 (5-hydroxy-2,6,6,9-tetramethyl-4-[(2-methylbut-2-enoyl)oxy]-11-oxotricyclo[5.4.0.0²,⁸]undec-9-en-3-yl 2-methylbut-2-enoate)

3D MOL for NP0175843 (5-hydroxy-2,6,6,9-tetramethyl-4-[(2-methylbut-2-enoyl)oxy]-11-oxotricyclo[5.4.0.0²,⁸]undec-9-en-3-yl 2-methylbut-2-enoate)

3D SDF for NP0175843 (5-hydroxy-2,6,6,9-tetramethyl-4-[(2-methylbut-2-enoyl)oxy]-11-oxotricyclo[5.4.0.0²,⁸]undec-9-en-3-yl 2-methylbut-2-enoate)

3D-SDF for NP0175843 (5-hydroxy-2,6,6,9-tetramethyl-4-[(2-methylbut-2-enoyl)oxy]-11-oxotricyclo[5.4.0.0²,⁸]undec-9-en-3-yl 2-methylbut-2-enoate)

PDB for NP0175843 (5-hydroxy-2,6,6,9-tetramethyl-4-[(2-methylbut-2-enoyl)oxy]-11-oxotricyclo[5.4.0.0²,⁸]undec-9-en-3-yl 2-methylbut-2-enoate)

3D PDB for NP0175843 (5-hydroxy-2,6,6,9-tetramethyl-4-[(2-methylbut-2-enoyl)oxy]-11-oxotricyclo[5.4.0.0²,⁸]undec-9-en-3-yl 2-methylbut-2-enoate)

SMILES for NP0175843 (5-hydroxy-2,6,6,9-tetramethyl-4-[(2-methylbut-2-enoyl)oxy]-11-oxotricyclo[5.4.0.0²,⁸]undec-9-en-3-yl 2-methylbut-2-enoate)

INCHI for NP0175843 (5-hydroxy-2,6,6,9-tetramethyl-4-[(2-methylbut-2-enoyl)oxy]-11-oxotricyclo[5.4.0.0²,⁸]undec-9-en-3-yl 2-methylbut-2-enoate)

Structure for NP0175843 (5-hydroxy-2,6,6,9-tetramethyl-4-[(2-methylbut-2-enoyl)oxy]-11-oxotricyclo[5.4.0.0²,⁸]undec-9-en-3-yl 2-methylbut-2-enoate)

3D Structure for NP0175843 (5-hydroxy-2,6,6,9-tetramethyl-4-[(2-methylbut-2-enoyl)oxy]-11-oxotricyclo[5.4.0.0²,⁸]undec-9-en-3-yl 2-methylbut-2-enoate)