NP-MRD: Showing NP-Card for 6,10,14-trimethylpentadecan-2-one (NP0318442)

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Record Information

Version

2.0

Created at

2022-09-11 18:56:42 UTC

Updated at

2022-09-11 18:56:42 UTC

NP-MRD ID

NP0318442

Secondary Accession Numbers

None

Natural Product Identification

Common Name

6,10,14-trimethylpentadecan-2-one

Description

6,10,14-Trimethylpentadecan-2-one belongs to the class of organic compounds known as sesquiterpenoids. These are terpenes with three consecutive isoprene units. 6,10,14-trimethylpentadecan-2-one is found in Aucuba japonica, Azolla nilotica, Catharanthus roseus, Cecropia pachystachya, Chrysanthemum indicum, Cladophora vagabunda, Clinopodium serpyllifolium, Marrubium parviflorum, Micromeria cristata, Morina persica, Nardia scalaris, Nepeta racemosa, Ocimum basilicum, Pelargonium endlicherianum, Phyllanthus niruri, Salvia absconditiflora, Salvia caespitosa, Salvia syriaca, Saussurea involucrata, Scutellaria baicalensis, Scutellaria barbata, Thymus zygioides and Tilia tomentosa. 6,10,14-Trimethylpentadecan-2-one is an extremely weak basic (essentially neutral) compound (based on its pKa).

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 55 54  0  0  0  0  0  0  0  0999 V2000
    6.5907   -2.0079    1.5603 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1736   -1.7113    1.3019 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3181   -2.5459    1.5061 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7962   -0.3678    0.7834 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6040   -0.4905   -0.6932 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2297    0.7401   -1.4185 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9728    1.4239   -1.0490 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.9683    2.1077    0.2928 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7345    0.5772   -1.2107 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4822    1.4533   -1.1092 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7661    0.6196   -1.2696 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9571    1.5417   -1.1596 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.8740    2.3478    0.1011 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2574    0.7921   -1.3087 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4709   -0.1830   -0.1628 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7596   -0.9247   -0.3084 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9090   -1.8755    0.8631 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1970   -2.6514    0.7652 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8799   -1.1284    2.1626 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0198   -2.5561    0.6774 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7195   -2.6016    2.4970 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2214   -1.1104    1.6843 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8234   -0.0787    1.2785 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6056    0.3288    1.0783 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5501   -0.8717   -1.1727 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8825   -1.3392   -0.8422 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0609    1.4688   -1.3149 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1757    0.4855   -2.5044 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8456    2.2464   -1.8240 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2333    1.6649    0.9978 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5976    3.1578    0.1422 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9818    2.2388    0.7204 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6841   -0.1776   -0.3989 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6774    0.0568   -2.1621 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4924    2.2203   -1.9038 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4811    1.8968   -0.0870 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8088   -0.0981   -0.4204 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7822    0.0790   -2.2248 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9198    2.2642   -2.0208 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1488    3.1959   -0.0412 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8392    2.8218    0.3760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4455    1.7479    0.9366 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2166    0.2510   -2.2700 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1217    1.4815   -1.3435 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3570    0.3260    0.8164 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6502   -0.9431   -0.2130 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6058   -0.2348   -0.4188 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6781   -1.5653   -1.2159 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0424   -2.5610    0.8275 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0771   -2.0521    1.0341 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3386   -3.0180   -0.2703 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1756   -3.5462    1.4153 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1726   -0.0735    2.0273 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8761   -1.2204    2.6408 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5954   -1.6015    2.8552 H   0  0  0  0  0  0  0  0  0  0  0  0
 18 17  1  0
 17 19  1  0
 17 16  1  0
 16 15  1  0
 15 14  1  0
 14 12  1  0
 12 13  1  0
 12 11  1  0
 11 10  1  0
 10  9  1  0
  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  2  0
 18 50  1  0
 18 51  1  0
 18 52  1  0
 17 49  1  0
 19 53  1  0
 19 54  1  0
 19 55  1  0
 16 47  1  0
 16 48  1  0
 15 45  1  0
 15 46  1  0
 14 43  1  0
 14 44  1  0
 12 39  1  6
 13 40  1  0
 13 41  1  0
 13 42  1  0
 11 37  1  0
 11 38  1  0
 10 35  1  0
 10 36  1  0
  9 33  1  0
  9 34  1  0
  7 29  1  6
  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 23  1  0
  4 24  1  0
  1 20  1  0
  1 21  1  0
  1 22  1  0
M  END


  Mrv0541 02241221252D          

 19 18  0  0  0  0            999 V2000
    6.7105   -4.6993    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4250   -4.2868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1395   -4.6993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8539   -4.2868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5684   -4.6993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2829   -4.2868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9974   -4.6993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7118   -4.2868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4263   -4.6993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1408   -4.2868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1408   -3.4618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8552   -4.6993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5697   -4.2868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2842   -4.6993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9987   -4.2868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9987   -3.4618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7131   -4.6993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2829   -3.4618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4250   -3.4618    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  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
 10 11  1  0  0  0  0
 10 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
  6 18  1  0  0  0  0
  2 19  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0318442

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CC(C)CCCC(C)CCCC(C)CCCC(C)=O

> <INCHI_IDENTIFIER>
InChI=1S/C18H36O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h15-17H,6-14H2,1-5H3

> <INCHI_KEY>
WHWDWIHXSPCOKZ-UHFFFAOYSA-N

> <FORMULA>
C18H36O

> <MOLECULAR_WEIGHT>
268.4778

> <EXACT_MASS>
268.276615774

> <JCHEM_ACCEPTOR_COUNT>
1

> <JCHEM_AVERAGE_POLARIZABILITY>
36.15854201956746

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
6,10,14-trimethylpentadecan-2-one

> <ALOGPS_LOGP>
7.48

> <JCHEM_LOGP>
6.558128259333333

> <ALOGPS_LOGS>
-6.83

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_ACIDIC>
19.643326578756167

> <JCHEM_PKA_STRONGEST_BASIC>
-7.270869926130766

> <JCHEM_POLAR_SURFACE_AREA>
17.07

> <JCHEM_REFRACTIVITY>
85.0785

> <JCHEM_ROTATABLE_BOND_COUNT>
12

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
3.97e-05 g/l

> <JCHEM_TRADITIONAL_IUPAC>
6,10,14-trimethylpentadecan-2-one

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  O   UNK     0      12.526  -8.772   0.000  0.00  0.00           O+0
HETATM    2  C   UNK     0      13.860  -8.002   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      15.194  -8.772   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      16.527  -8.002   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      17.861  -8.772   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      19.195  -8.002   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      20.528  -8.772   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      21.862  -8.002   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      23.196  -8.772   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      24.529  -8.002   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      24.529  -6.462   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      25.863  -8.772   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      27.197  -8.002   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      28.531  -8.772   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      29.864  -8.002   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      29.864  -6.462   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      31.198  -8.772   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      19.195  -6.462   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      13.860  -6.462   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3   19                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5                                                       
CONECT    5    4    6                                                       
CONECT    6    5    7   18                                                  
CONECT    7    6    8                                                       
CONECT    8    7    9                                                       
CONECT    9    8   10                                                       
CONECT   10    9   11   12                                                  
CONECT   11   10                                                            
CONECT   12   10   13                                                       
CONECT   13   12   14                                                       
CONECT   14   13   15                                                       
CONECT   15   14   16   17                                                  
CONECT   16   15                                                            
CONECT   17   15                                                            
CONECT   18    6                                                            
CONECT   19    2                                                            
MASTER        0    0    0    0    0    0    0    0   19    0   36    0
END

View in JSmol

Synonyms

Value	Source
Hexahydrofarnesylacetone	MeSH

Chemical Formula

C₁₈H₃₆O

Average Mass

268.4778 Da

Monoisotopic Mass

268.27662 Da

IUPAC Name

6,10,14-trimethylpentadecan-2-one

Traditional Name

6,10,14-trimethylpentadecan-2-one

CAS Registry Number

Not Available

SMILES

CC(C)CCCC(C)CCCC(C)CCCC(C)=O

InChI Identifier

InChI=1S/C18H36O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h15-17H,6-14H2,1-5H3

InChI Key

WHWDWIHXSPCOKZ-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
Aucuba japonica	LOTUS Database	35616633
Azolla nilotica	LOTUS Database	35616633
Catharanthus roseus	LOTUS Database	35616633
Cecropia pachystachya	LOTUS Database	35616633
Chrysanthemum indicum	LOTUS Database	35616633
Cladophora vagabunda	LOTUS Database	35616633
Clinopodium serpyllifolium	LOTUS Database	35616633
Marrubium parviflorum	LOTUS Database	35616633
Micromeria cristata	LOTUS Database	35616633
Morina persica	LOTUS Database	35616633
Nardia scalaris	LOTUS Database	35616633
Nepeta racemosa	LOTUS Database	35616633
Ocimum basilicum	LOTUS Database	35616633
Pelargonium endlicherianum	LOTUS Database	35616633
Phyllanthus niruri	LOTUS Database	35616633
Salvia absconditiflora	LOTUS Database	35616633
Salvia caespitosa	LOTUS Database	35616633
Salvia syriaca	LOTUS Database	35616633
Saussurea involucrata	LOTUS Database	35616633
Scutellaria baicalensis	LOTUS Database	35616633
Scutellaria barbata	LOTUS Database	35616633
Thymus zygioides	LOTUS Database	35616633
Tilia tomentosa	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

Farsesane sesquiterpenoid
Sesquiterpenoid
Ketone
Organic oxygen compound
Organic oxide
Hydrocarbon derivative
Organooxygen compound
Carbonyl group
Aliphatic acyclic compound

Molecular Framework

Aliphatic acyclic 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	7.48	ALOGPS
logP	6.56	ChemAxon
logS	-6.8	ALOGPS
pKa (Strongest Acidic)	19.64	ChemAxon
pKa (Strongest Basic)	-7.3	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	1	ChemAxon
Hydrogen Donor Count	0	ChemAxon
Polar Surface Area	17.07 Å²	ChemAxon
Rotatable Bond Count	12	ChemAxon
Refractivity	85.08 m³·mol⁻¹	ChemAxon
Polarizability	36.16 Å³	ChemAxon
Number of Rings	0	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

FDB007640

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

10408

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

LOTUS database [Link]

Showing NP-Card for 6,10,14-trimethylpentadecan-2-one (NP0318442)

MOL for NP0318442 (6,10,14-trimethylpentadecan-2-one)

3D MOL for NP0318442 (6,10,14-trimethylpentadecan-2-one)

3D SDF for NP0318442 (6,10,14-trimethylpentadecan-2-one)

3D-SDF for NP0318442 (6,10,14-trimethylpentadecan-2-one)

PDB for NP0318442 (6,10,14-trimethylpentadecan-2-one)

3D PDB for NP0318442 (6,10,14-trimethylpentadecan-2-one)

SMILES for NP0318442 (6,10,14-trimethylpentadecan-2-one)

INCHI for NP0318442 (6,10,14-trimethylpentadecan-2-one)

Structure for NP0318442 (6,10,14-trimethylpentadecan-2-one)

3D Structure for NP0318442 (6,10,14-trimethylpentadecan-2-one)