NP-MRD: Showing NP-Card for (-)-cubebol (NP0329116)

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Record Information

Version

2.0

Created at

2022-09-12 13:11:50 UTC

Updated at

2022-09-12 13:11:51 UTC

NP-MRD ID

NP0329116

Secondary Accession Numbers

None

Natural Product Identification

Common Name

(-)-cubebol

Description

(-)-Cubebol, also known as cubeb camphor, belongs to the class of organic compounds known as sesquiterpenoids. (-)-cubebol is found in Abies sibirica, Acritopappus confertus, Ajuga chamaepitys, Cryptomeria japonica, Ekimia bornmuelleri, Peperomia circinnata, Picea glehnii, Picea koraiensis, Pinus densiflora, Piper aduncum, Taonia atomaria, Teucrium leucocladum, Teucrium sandrasicum and Toona ciliata. (-)-cubebol was first documented in 2009 (PMID: 19691071). These are terpenes with three consecutive isoprene units (-)-cubebol is an extremely weak basic (essentially neutral) compound (based on its pKa) (PMID: 20419721) (PMID: 20063852).

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 42 44  0  0  0  0  0  0  0  0999 V2000
    3.9128    0.3634   -0.1052 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6402   -0.2344    0.4499 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7611   -1.7447    0.4255 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4426    0.1110   -0.4375 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.3645    1.5584   -0.7499 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6809    2.2970    0.3490 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6888    1.7861    0.6513 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.7026    2.5886   -0.1760 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8746    0.3326    0.5292 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.9237   -0.2711    1.4395 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0796   -1.6877    0.9866 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9454   -1.5648   -0.5357 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.2725   -1.4028   -1.1840 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2892   -2.7456   -0.9399 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0126   -0.4116   -0.7174 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.2388   -0.5001    0.1586 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.9738    0.2505   -1.2036 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0810    1.3975    0.2417 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7569   -0.2469    0.3152 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4733    0.1313    1.4703 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8386   -2.0382    0.4517 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3175   -2.1438   -0.5094 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2173   -2.2114    1.2892 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6541   -0.4284   -1.4093 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8460    1.7095   -1.7284 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4084    1.9615   -0.8289 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5747    3.3847    0.0744 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3206    2.2683    1.2575 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9154    2.0809    1.7190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7540    2.2488   -1.2103 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3469    3.6543   -0.0926 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6706    2.5499    0.3663 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7080   -0.1524    2.5005 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8863    0.2600    1.1811 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0831   -2.0469    1.2738 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3138   -2.3652    1.4082 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9791   -0.9846   -0.4187 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6675   -2.4361   -1.4043 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2669   -0.8426   -2.1224 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6167   -3.0934   -1.7840 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9209    0.0475   -1.7179 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4153   -1.4289    0.7368 H   0  0  0  0  0  0  0  0  0  0  0  0
 16 15  1  0
 15  9  1  0
  9 10  1  1
 10 11  1  0
 11 12  1  0
 12 13  1  0
 12 14  1  6
  9  7  1  0
  7  8  1  0
  7  6  1  0
  6  5  1  0
  5  4  1  0
  4  2  1  0
  2  1  1  0
  2  3  1  0
  9 16  1  0
  4 16  1  0
 12 15  1  0
 16 42  1  1
 15 41  1  6
 10 33  1  0
 10 34  1  0
 11 35  1  0
 11 36  1  0
 13 37  1  0
 13 38  1  0
 13 39  1  0
 14 40  1  0
  7 29  1  1
  8 30  1  0
  8 31  1  0
  8 32  1  0
  6 27  1  0
  6 28  1  0
  5 25  1  0
  5 26  1  0
  4 24  1  6
  2 20  1  0
  1 17  1  0
  1 18  1  0
  1 19  1  0
  3 21  1  0
  3 22  1  0
  3 23  1  0
M  END


  Mrv1572004251600532D          

 20 22  0  0  1  0            999 V2000
    2.4747    3.2712    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7452    2.6171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4105   -0.3565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0280    2.3698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6122    0.4166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9899    1.1501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0509    0.7307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8199    0.4318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9211    2.5774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7882    0.3770    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.5435    1.8439    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.7194    1.8042    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.8954    1.7645    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.0976    1.5544    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.3418    1.0708    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.7264    1.5147    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2346   -0.3168    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3675    1.8836    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6797    2.6283    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7698    2.5799    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  6  5  1  0  0  0  0
  8  7  1  0  0  0  0
  9  1  1  0  0  0  0
  9  2  1  0  0  0  0
 10  3  1  1  0  0  0
 10  5  1  0  0  0  0
 11  6  1  0  0  0  0
 11  9  1  6  0  0  0
 12 11  1  0  0  0  0
 13 12  1  0  0  0  0
 14  4  1  1  0  0  0
 14  7  1  0  0  0  0
 14 13  1  0  0  0  0
 15  8  1  6  0  0  0
 15 10  1  0  0  0  0
 15 12  1  0  0  0  0
 15 13  1  0  0  0  0
 14 16  1  6  0  0  0
 10 17  1  6  0  0  0
 11 18  1  1  0  0  0
 12 19  1  6  0  0  0
 13 20  1  1  0  0  0
M  END
> <DATABASE_ID>
NP0329116

> <DATABASE_NAME>
NP-MRD

> <SMILES>
[H][C@@]12[C@]3([H])[C@]1(CC[C@]3(C)O)[C@]([H])(C)CC[C@@]2([H])C(C)C

> <INCHI_IDENTIFIER>
InChI=1S/C15H26O/c1-9(2)11-6-5-10(3)15-8-7-14(4,16)13(15)12(11)15/h9-13,16H,5-8H2,1-4H3/t10-,11+,12-,13+,14+,15-/m1/s1

> <INCHI_KEY>
KONGRWVLXLWGDV-BYGOPZEFSA-N

> <FORMULA>
C15H26O

> <MOLECULAR_WEIGHT>
222.372

> <EXACT_MASS>
222.198365457

> <JCHEM_ACCEPTOR_COUNT>
1

> <JCHEM_ATOM_COUNT>
42

> <JCHEM_AVERAGE_POLARIZABILITY>
27.446667116137462

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
(1R,4S,5R,6R,7S,10R)-4,10-dimethyl-7-(propan-2-yl)tricyclo[4.4.0.0¹,⁵]decan-4-ol

> <ALOGPS_LOGP>
2.93

> <JCHEM_LOGP>
3.1785024189999995

> <ALOGPS_LOGS>
-4.77

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_ACIDIC>
19.3935086763188

> <JCHEM_PKA_STRONGEST_BASIC>
-0.8770793049781566

> <JCHEM_POLAR_SURFACE_AREA>
20.23

> <JCHEM_REFRACTIVITY>
66.60000000000001

> <JCHEM_ROTATABLE_BOND_COUNT>
1

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
3.81e-03 g/l

> <JCHEM_TRADITIONAL_IUPAC>
(-)-cubebol

> <JCHEM_VEBER_RULE>
1

$$$$

HEADER    PROTEIN                                 25-APR-16   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   25-APR-16         0                                  
HETATM    1  C   UNK     0       4.619   6.106   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       6.991   4.885   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       2.633  -0.666   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -0.052   4.424   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       4.876   0.778   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       5.581   2.147   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       0.095   1.364   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       1.530   0.806   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       5.453   4.811   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       3.338   0.704   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       4.748   3.442   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       3.210   3.368   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       1.671   3.294   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       0.182   2.902   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       2.505   1.999   0.000  0.00  0.00           C+0
HETATM   16  O   UNK     0      -1.356   2.827   0.000  0.00  0.00           O+0
HETATM   17  H   UNK     0       4.171  -0.591   0.000  0.00  0.00           H+0
HETATM   18  H   UNK     0       6.286   3.516   0.000  0.00  0.00           H+0
HETATM   19  H   UNK     0       3.136   4.906   0.000  0.00  0.00           H+0
HETATM   20  H   UNK     0       1.437   4.816   0.000  0.00  0.00           H+0
CONECT    1    9                                                            
CONECT    2    9                                                            
CONECT    3   10                                                            
CONECT    4   14                                                            
CONECT    5    6   10                                                       
CONECT    6    5   11                                                       
CONECT    7    8   14                                                       
CONECT    8    7   15                                                       
CONECT    9    1    2   11                                                  
CONECT   10    3    5   15   17                                             
CONECT   11    6    9   12   18                                             
CONECT   12   11   13   15   19                                             
CONECT   13   12   14   15   20                                             
CONECT   14    4    7   13   16                                             
CONECT   15    8   10   12   13                                             
CONECT   16   14                                                            
CONECT   17   10                                                            
CONECT   18   11                                                            
CONECT   19   12                                                            
CONECT   20   13                                                            
MASTER        0    0    0    0    0    0    0    0   20    0   44    0
END

View in JSmol

Synonyms

Value	Source
(-)-(1R,4S,5R,6R,7S,10R)-7-Isopropyl-4,10-dimethyl-tricyclo[4.4.0.0(1,5)]decan-4-ol	ChEBI
(1R,4S,5R,6R,7S,10R)-7-Isopropyl-4,10-dimethyl-tricyclo[4.4.0.0(1,5)]decan-4-ol	ChEBI
Cubeb camphor	ChEBI
Cubebol	ChEBI

Chemical Formula

C₁₅H₂₆O

Average Mass

222.3720 Da

Monoisotopic Mass

222.19837 Da

IUPAC Name

(1R,4S,5R,6R,7S,10R)-4,10-dimethyl-7-(propan-2-yl)tricyclo[4.4.0.0¹,⁵]decan-4-ol

Traditional Name

(-)-cubebol

CAS Registry Number

Not Available

SMILES

[H][C@@]12[C@]3([H])[C@]1(CC[C@]3(C)O)[C@]([H])(C)CC[C@@]2([H])C(C)C

InChI Identifier

InChI=1S/C15H26O/c1-9(2)11-6-5-10(3)15-8-7-14(4,16)13(15)12(11)15/h9-13,16H,5-8H2,1-4H3/t10-,11+,12-,13+,14+,15-/m1/s1

InChI Key

KONGRWVLXLWGDV-BYGOPZEFSA-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
Abies sibirica	LOTUS Database	35616633
Acritopappus confertus	LOTUS Database	35616633
Ajuga chamaepitys	LOTUS Database	35616633
Cryptomeria japonica	LOTUS Database	35616633
Ekimia bornmuelleri	LOTUS Database	35616633
Peperomia circinnata	LOTUS Database	35616633
Picea glehnii	LOTUS Database	35616633
Picea koraiensis	LOTUS Database	35616633
Pinus densiflora	LOTUS Database	35616633
Piper aduncum	LOTUS Database	35616633
Taonia atomaria	LOTUS Database	35616633
Teucrium leucocladum	LOTUS Database	35616633
Teucrium sandrasicum	LOTUS Database	35616633
Toona ciliata	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as sesquiterpenoids. These are terpenes with three consecutive isoprene units.

Kingdom

Organic compounds

Super Class

Lipids and lipid-like molecules

Class

Prenol lipids

Sub Class

Sesquiterpenoids

Direct Parent

Sesquiterpenoids

Alternative Parents

Substituents

Cubebane sesquiterpenoid
Sesquiterpenoid
Tertiary alcohol
Cyclic alcohol
Organic oxygen compound
Hydrocarbon derivative
Organooxygen compound
Alcohol
Aliphatic homopolycyclic compound

Molecular Framework

Aliphatic homopolycyclic compounds

External Descriptors

tertiary alcohol (CHEBI:63446 )
sesquiterpenoid (CHEBI:63446 )
carbotricyclic compound (CHEBI:63446 )

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	2.93	ALOGPS
logP	3.18	ChemAxon
logS	-4.8	ALOGPS
pKa (Strongest Acidic)	19.39	ChemAxon
pKa (Strongest Basic)	-0.88	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	1	ChemAxon
Hydrogen Donor Count	1	ChemAxon
Polar Surface Area	20.23 Å²	ChemAxon
Rotatable Bond Count	1	ChemAxon
Refractivity	66.6 m³·mol⁻¹	ChemAxon
Polarizability	27.45 Å³	ChemAxon
Number of Rings	3	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	Yes	ChemAxon
Veber's Rule	Yes	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

11276107

PDB ID

Not Available

ChEBI ID

63446

Good Scents ID

Not Available

References

General References

Lopez-Gallego F, Agger SA, Abate-Pella D, Distefano MD, Schmidt-Dannert C: Sesquiterpene synthases Cop4 and Cop6 from Coprinus cinereus: catalytic promiscuity and cyclization of farnesyl pyrophosphate geometric isomers. Chembiochem. 2010 May 17;11(8):1093-106. doi: 10.1002/cbic.200900671. [PubMed:20419721 ]
Hodgson DM, Salik S, Fox DJ: Stereocontrolled syntheses of (-)-cubebol and (-)-10-epicubebol involving intramolecular cyclopropanation of alpha-lithiated epoxides. J Org Chem. 2010 Apr 2;75(7):2157-68. doi: 10.1021/jo9022974. [PubMed:20063852 ]
Fehr C, Winter B, Magpantay I: Synthesis of (-)-cubebol by face-selective platinum-, gold-, or copper-catalyzed cycloisomerization: evidence of chirality transfer and mechanistic insights. Chemistry. 2009 Sep 28;15(38):9773-84. doi: 10.1002/chem.200901292. [PubMed:19691071 ]
LOTUS database [Link]

Showing NP-Card for (-)-cubebol (NP0329116)

MOL for NP0329116 ((-)-cubebol)

3D MOL for NP0329116 ((-)-cubebol)

3D SDF for NP0329116 ((-)-cubebol)

3D-SDF for NP0329116 ((-)-cubebol)

PDB for NP0329116 ((-)-cubebol)

3D PDB for NP0329116 ((-)-cubebol)

SMILES for NP0329116 ((-)-cubebol)

INCHI for NP0329116 ((-)-cubebol)

Structure for NP0329116 ((-)-cubebol)

3D Structure for NP0329116 ((-)-cubebol)