NP-MRD: Showing NP-Card for lactobacillic acid (NP0315736)

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Record Information

Version

2.0

Created at

2022-09-11 14:31:01 UTC

Updated at

2022-09-11 14:31:01 UTC

NP-MRD ID

NP0315736

Secondary Accession Numbers

None

Natural Product Identification

Common Name

lactobacillic acid

Description

Lactobacillic acid, also known as phytomonic acid or 11,12-MT 18:0, Belongs to the class of organic compounds known as medium-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 4 and 12 carbon atoms. lactobacillic acid is found in Dictyostelium discoideum, Litchi chinensis and Pseudo-nitzschia multistriata. lactobacillic acid was first documented in 2018 (PMID: 30349012). Based on a literature review a small amount of articles have been published on lactobacillic acid (PMID: 35816729) (PMID: 33965789) (PMID: 33260946) (PMID: 31763377).

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 57 57  0  0  0  0  0  0  0  0999 V2000
   -5.0792    3.2293   -1.4936 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2149    1.7354   -1.3853 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8876    1.3465    0.0557 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0102   -0.1540    0.2151 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0723   -0.8989   -0.6929 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6114   -0.5418   -0.4138 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3066   -0.9026    0.9972 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.4457   -2.3442    1.4035 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1415   -1.5747    1.5309 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.0160   -2.1134    0.7852 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8132   -1.0737    0.0115 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9521   -1.7937   -0.6929 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8872   -2.4599    0.2171 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6704   -1.5809    1.1124 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7198   -0.7453    0.5444 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5608    0.2996   -0.4542 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6954    1.4698   -0.1578 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6989    2.4035   -1.3495 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0009    2.9705   -1.6896 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0771    3.5967   -2.7963 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1554    2.9092   -0.9528 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5697    3.5240   -2.4516 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4799    3.6659   -0.6703 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0828    3.7218   -1.4707 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4463    1.2594   -2.0321 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2174    1.3762   -1.6346 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6743    1.8309    0.6761 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8797    1.7164    0.2674 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8285   -0.4436    1.2498 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0390   -0.4253   -0.0775 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2702   -0.7628   -1.7576 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1772   -1.9822   -0.4460 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0464   -1.1529   -1.1712 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3908    0.5163   -0.5971 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8579   -0.2252    1.7237 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9524   -2.6288    2.3395 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5906   -3.0496    0.5839 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8533   -1.3260    2.6162 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2850   -2.8658    0.0068 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6504   -2.6938    1.4875 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1434   -0.2704    0.6657 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1671   -0.6649   -0.7720 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4793   -2.5201   -1.4103 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4383   -1.0518   -1.3219 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6301   -3.0149   -0.4660 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4334   -3.3348    0.7684 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1356   -2.2858    1.8984 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9447   -0.9992    1.7663 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5241   -1.4613    0.0937 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3525   -0.3412    1.4247 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6230    0.7653   -0.5537 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3936   -0.0593   -1.4919 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6515    1.2660    0.0647 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1139    2.0836    0.6905 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3629    1.7798   -2.2321 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9599    3.2265   -1.2214 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1596    3.0500    0.0485 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 21  1  0
 19 20  2  0
  9  7  1  0
  1 22  1  0
  1 23  1  0
  1 24  1  0
  2 25  1  0
  2 26  1  0
  3 27  1  0
  3 28  1  0
  4 29  1  0
  4 30  1  0
  5 31  1  0
  5 32  1  0
  6 33  1  0
  6 34  1  0
  7 35  1  1
  8 36  1  0
  8 37  1  0
  9 38  1  1
 10 39  1  0
 10 40  1  0
 11 41  1  0
 11 42  1  0
 12 43  1  0
 12 44  1  0
 13 45  1  0
 13 46  1  0
 14 47  1  0
 14 48  1  0
 15 49  1  0
 15 50  1  0
 16 51  1  0
 16 52  1  0
 17 53  1  0
 17 54  1  0
 18 55  1  0
 18 56  1  0
 21 57  1  0
M  END


  Mrv1652309112216312D          

 21 21  0  0  1  0            999 V2000
   -3.9849   -2.1730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2704   -1.7605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2704   -0.9355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5559   -0.5230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5559    0.3020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8414    0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8414    1.5395    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.2539    2.2539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    2.2539    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.7145    2.6664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0000    2.2539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    2.6664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    2.2539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    2.6664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    2.2539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    2.6664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    2.2539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013    2.6664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158    2.2539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4302    2.6664    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158    1.4289    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
  7  6  1  1  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  7  9  1  0  0  0  0
  9 10  1  1  0  0  0
 10 11  1  0  0  0  0
 11 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
 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
M  END
> <DATABASE_ID>
NP0315736

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CCCCCC[C@H]1C[C@H]1CCCCCCCCCC(O)=O

> <INCHI_IDENTIFIER>
InChI=1S/C19H36O2/c1-2-3-4-10-13-17-16-18(17)14-11-8-6-5-7-9-12-15-19(20)21/h17-18H,2-16H2,1H3,(H,20,21)/t17-,18+/m0/s1

> <INCHI_KEY>
IJKRDVKGCQRKBI-ZWKOTPCHSA-N

> <FORMULA>
C19H36O2

> <MOLECULAR_WEIGHT>
296.495

> <EXACT_MASS>
296.271530399

> <JCHEM_ACCEPTOR_COUNT>
2

> <JCHEM_ATOM_COUNT>
57

> <JCHEM_AVERAGE_POLARIZABILITY>
39.27051684912179

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
10-[(1R,2S)-2-hexylcyclopropyl]decanoic acid

> <JCHEM_LOGP>
6.811463732666668

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA_STRONGEST_ACIDIC>
4.952019655228562

> <JCHEM_POLAR_SURFACE_AREA>
37.3

> <JCHEM_REFRACTIVITY>
88.97959999999998

> <JCHEM_ROTATABLE_BOND_COUNT>
15

> <JCHEM_RULE_OF_FIVE>
0

> <JCHEM_TRADITIONAL_IUPAC>
lactobacillic acid

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 11-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   11-SEP-22         0                                  
HETATM    1  C   UNK     0      -7.438  -4.056   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -6.105  -3.286   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -6.105  -1.746   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -4.771  -0.976   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      -4.771   0.564   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -3.437   1.334   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      -3.437   2.874   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -4.207   4.207   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      -2.667   4.207   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      -1.334   4.977   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -0.000   4.207   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       1.334   4.977   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       2.667   4.207   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       4.001   4.977   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       5.335   4.207   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       6.668   4.977   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       8.002   4.207   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       9.336   4.977   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      10.669   4.207   0.000  0.00  0.00           C+0
HETATM   20  O   UNK     0      12.003   4.977   0.000  0.00  0.00           O+0
HETATM   21  O   UNK     0      10.669   2.667   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3                                                       
CONECT    3    2    4                                                       
CONECT    4    3    5                                                       
CONECT    5    4    6                                                       
CONECT    6    5    7                                                       
CONECT    7    6    8    9                                                  
CONECT    8    7    9                                                       
CONECT    9    8    7   10                                                  
CONECT   10    9   11                                                       
CONECT   11   10   12                                                       
CONECT   12   11   13                                                       
CONECT   13   12   14                                                       
CONECT   14   13   15                                                       
CONECT   15   14   16                                                       
CONECT   16   15   17                                                       
CONECT   17   16   18                                                       
CONECT   18   17   19                                                       
CONECT   19   18   20   21                                                  
CONECT   20   19                                                            
CONECT   21   19                                                            
MASTER        0    0    0    0    0    0    0    0   21    0   42    0
END

View in JSmol

Synonyms

Value	Source
(11R,12S)-Lactobacillic acid	ChEBI
(1R,2S)-1-(9'-Carboxynon-1'-yl)-2-hexylcyclopropane	ChEBI
(1R,2S)-2-Hexylcyclopropanedecanoic acid	ChEBI
(R,S)-11,12-Methyleneoctadecanoic acid	ChEBI
11,12-MT 18:0	ChEBI
11R,12S-Methylene-octadecanoic acid	ChEBI
Acide-methylene-11R,12S-octadecanoique	ChEBI
C19:0 Cyclov8c	ChEBI
Lactobacillsaeure	ChEBI
Phytomonic acid	ChEBI
Phytomonsaeure	ChEBI
(11R,12S)-Lactobacillate	Generator
(1R,2S)-2-Hexylcyclopropanedecanoate	Generator
(R,S)-11,12-Methyleneoctadecanoate	Generator
11R,12S-Methylene-octadecanoate	Generator
Phytomonate	Generator
Lactobacillate	Generator
cis-11,12-Methyleneoctadecanoic acid	MeSH
Phytomonic acid, (cis-(1R))-isomer	MeSH

Chemical Formula

C₁₉H₃₆O₂

Average Mass

296.4950 Da

Monoisotopic Mass

296.27153 Da

IUPAC Name

10-[(1R,2S)-2-hexylcyclopropyl]decanoic acid

Traditional Name

lactobacillic acid

CAS Registry Number

Not Available

SMILES

CCCCCC[C@H]1C[C@H]1CCCCCCCCCC(O)=O

InChI Identifier

InChI=1S/C19H36O2/c1-2-3-4-10-13-17-16-18(17)14-11-8-6-5-7-9-12-15-19(20)21/h17-18H,2-16H2,1H3,(H,20,21)/t17-,18+/m0/s1

InChI Key

IJKRDVKGCQRKBI-ZWKOTPCHSA-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
Dictyostelium discoideum	LOTUS Database	35616633
Litchi chinensis	LOTUS Database	35616633
Pseudo-nitzschia multistriata	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as medium-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 4 and 12 carbon atoms.

Kingdom

Organic compounds

Super Class

Lipids and lipid-like molecules

Class

Fatty Acyls

Sub Class

Fatty acids and conjugates

Direct Parent

Medium-chain fatty acids

Alternative Parents

Substituents

Medium-chain fatty acid
Monocarboxylic acid or derivatives
Carboxylic acid
Carboxylic acid derivative
Organic oxygen compound
Organic oxide
Hydrocarbon derivative
Organooxygen compound
Carbonyl group
Aliphatic homomonocyclic compound

Molecular Framework

Aliphatic homomonocyclic compounds

External Descriptors

11,12-methyleneoctadecanoic acid (CHEBI:34811 )
Carbocyclic fatty acids (C13838 )
Carbocyclic fatty acids (LMFA01140001 )

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	6.81	ChemAxon
pKa (Strongest Acidic)	4.95	ChemAxon
Physiological Charge	-1	ChemAxon
Hydrogen Acceptor Count	2	ChemAxon
Hydrogen Donor Count	1	ChemAxon
Polar Surface Area	37.3 Å²	ChemAxon
Rotatable Bond Count	15	ChemAxon
Refractivity	88.98 m³·mol⁻¹	ChemAxon
Polarizability	39.27 Å³	ChemAxon
Number of Rings	1	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

Not Available

KNApSAcK ID

Not Available

Chemspider ID

571085

KEGG Compound ID

C13838

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

656761

PDB ID

Not Available

ChEBI ID

34811

Good Scents ID

Not Available

References

General References

Chang CC, Jan HM, Tseng CJ, Mondal S, Abera AB, Hsieh MY, Yang TC, Muthusamy S, Huang SC, Lin CH, Tony Mong KK: Metabolic Isolation, Stereochemical Determination, and Total Synthesis of Predominant Native Cholesteryl Phosphatidyl-alpha-glucoside from Carcinogenic Helicobacter pylori. Org Lett. 2022 Jul 22;24(28):5045-5050. doi: 10.1021/acs.orglett.2c01815. Epub 2022 Jul 11. [PubMed:35816729 ]
Suarez-Esquivel M, Ruiz-Villalobos N, Hidalgo-Jara W, Chacon-Diaz C, Zuniga-Pereira AM, Masis-Mora M, Fernandez-Fernandez E, Hernandez-Mora G, Barquero-Calvo E, Chaves-Olarte E, Thomson NR, Foster JT, Moreno E, Guzman-Verri C: Canine brucellosis in Costa Rica reveals widespread Brucella canis infection and the recent introduction of foreign strains. Vet Microbiol. 2021 Jun;257:109072. doi: 10.1016/j.vetmic.2021.109072. Epub 2021 Apr 16. [PubMed:33965789 ]
Lolli V, Zanardi E, Moloney AP, Caligiani A: An Overview on Cyclic Fatty Acids as Biomarkers of Quality and Authenticity in the Meat Sector. Foods. 2020 Nov 27;9(12):1756. doi: 10.3390/foods9121756. [PubMed:33260946 ]
Quach D, Parameswaran N, McCabe L, Britton RA: Characterizing how probiotic Lactobacillus reuteri 6475 and lactobacillic acid mediate suppression of osteoclast differentiation. Bone Rep. 2019 Nov 2;11:100227. doi: 10.1016/j.bonr.2019.100227. eCollection 2019 Dec. [PubMed:31763377 ]
Fontes AL, Pimentel L, Rodriguez-Alcala LM, Gomes A: Effect of Pufa Substrates on Fatty Acid Profile of Bifidobacterium breve Ncimb 702258 and CLA/CLNA Production in Commercial Semi-Skimmed Milk. Sci Rep. 2018 Oct 22;8(1):15591. doi: 10.1038/s41598-018-33970-2. [PubMed:30349012 ]
LOTUS database [Link]

Showing NP-Card for lactobacillic acid (NP0315736)

MOL for NP0315736 (lactobacillic acid)

3D MOL for NP0315736 (lactobacillic acid)

3D SDF for NP0315736 (lactobacillic acid)

3D-SDF for NP0315736 (lactobacillic acid)

PDB for NP0315736 (lactobacillic acid)

3D PDB for NP0315736 (lactobacillic acid)

SMILES for NP0315736 (lactobacillic acid)

INCHI for NP0315736 (lactobacillic acid)

Structure for NP0315736 (lactobacillic acid)

3D Structure for NP0315736 (lactobacillic acid)