NP-MRD: Showing NP-Card for N-Feruloyloctopamine (NP0137429)

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Record Information

Version

2.0

Created at

2022-05-30 16:52:13 UTC

Updated at

2022-05-30 16:52:13 UTC

NP-MRD ID

NP0137429

Secondary Accession Numbers

None

Natural Product Identification

Common Name

N-Feruloyloctopamine

Description

N-trans-Feruloyloctopamine belongs to the class of organic compounds known as hydroxycinnamic acids and derivatives. Hydroxycinnamic acids and derivatives are compounds containing an cinnamic acid (or a derivative thereof) where the benzene ring is hydroxylated. N-trans-Feruloyloctopamine is a moderately basic compound (based on its pKa). Outside of the human body, N-trans-Feruloyloctopamine is found, on average, in the highest concentration within a few different foods, such as yellow bell peppers, red bell peppers, and pepper (c. Annuum) and in a lower concentration in orange bell peppers and green bell peppers. N-trans-Feruloyloctopamine has also been detected, but not quantified in, several different foods, such as eggplants, fruits, herbs and spices, italian sweet red peppers, and potato. N-Feruloyloctopamine is found in Allium sativum, Antidesma membranaceum and Capnoides sempervirens. This could make N-trans-feruloyloctopamine a potential biomarker for the consumption of these foods.

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 43 44  0  0  0  0  0  0  0  0999 V2000
    7.0833    0.9777    2.0932 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2634    0.3711    0.8423 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1317   -0.0089    0.1169 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8729    0.1997    0.6032 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7413   -0.1853   -0.1323 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4259    0.0585    0.4287 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3323   -0.2773   -0.2078 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0027   -0.0308    0.3596 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0837    0.5156    1.4826 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1328   -0.4149   -0.3742 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4506   -0.1847    0.1592 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5355   -0.6686   -0.7813 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.4017    0.0255   -1.9768 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8387   -0.2898   -0.1883 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1672    1.0536   -0.1860 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3572    1.5097    0.3424 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2600    0.6294    0.8879 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4772    1.0647    1.4321 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9183   -0.7079    0.8784 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7311   -1.1731    0.3524 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9953   -0.7695   -1.3408 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2681   -0.9799   -1.8315 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3743   -0.6049   -1.1153 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6726   -0.7963   -1.5682 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3313    1.7787    2.0018 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7615    0.2132    2.8287 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0595    1.4411    2.3723 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6829    0.6610    1.5569 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3197    0.5215    1.3822 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3787   -0.7433   -1.1646 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0307   -0.8628   -1.2966 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5091   -0.7244    1.1266 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6132    0.8878    0.3550 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4543   -1.7517   -0.9808 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2457    0.4625   -2.2452 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5005    1.8094   -0.6013 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6080    2.5678    0.3404 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2622    1.1005    0.7640 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6152   -1.4239    1.3038 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4746   -2.2287    0.3514 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1264   -1.0833   -1.9428 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4093   -1.4434   -2.7874 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4397   -0.4959   -0.9889 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  8 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 12 14  1  0
 14 15  2  0
 15 16  1  0
 16 17  2  0
 17 18  1  0
 17 19  1  0
 19 20  2  0
  5 21  2  0
 21 22  1  0
 22 23  2  0
 23 24  1  0
 23  3  1  0
 20 14  1  0
  1 25  1  0
  1 26  1  0
  1 27  1  0
  4 28  1  0
  6 29  1  0
  7 30  1  0
 10 31  1  0
 11 32  1  0
 11 33  1  0
 12 34  1  6
 13 35  1  0
 15 36  1  0
 16 37  1  0
 18 38  1  0
 19 39  1  0
 20 40  1  0
 21 41  1  0
 22 42  1  0
 24 43  1  0
M  END


  Mrv0541 02241211112D          

 24 25  0  0  0  0            999 V2000
   -3.2567    0.8635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9181    0.4510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9181   -0.3740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2567   -0.7864    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5142   -0.3740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5142    0.4510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6607    0.8635    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0291    0.4510    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1117   -0.3740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7716   -0.7864    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7716   -1.6115    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2771    0.7906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1945    1.6115    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3925    0.3093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1447    0.6489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8143    0.1677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7346   -0.6545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4056   -1.1357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1578   -0.7961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2389    0.0248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5665    0.5060    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8273   -1.2774    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9897    0.3657    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6607   -0.1141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  6  1  0  0  0  0
  2  3  1  0  0  0  0
  2  7  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5 10  1  0  0  0  0
  8  9  1  0  0  0  0
  8 12  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 12 13  2  0  0  0  0
 12 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 16 21  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
 19 22  1  0  0  0  0
 20 21  2  0  0  0  0
 20 23  1  0  0  0  0
 23 24  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0137429

> <DATABASE_NAME>
NP-MRD

> <SMILES>
COC1=CC(\C=C\C(=O)NCC(O)C2=CC=C(O)C=C2)=CC=C1O

> <INCHI_IDENTIFIER>
InChI=1S/C18H19NO5/c1-24-17-10-12(2-8-15(17)21)3-9-18(23)19-11-16(22)13-4-6-14(20)7-5-13/h2-10,16,20-22H,11H2,1H3,(H,19,23)/b9-3+

> <INCHI_KEY>
VJSCHQMOTSXAKB-YCRREMRBSA-N

> <FORMULA>
C18H19NO5

> <MOLECULAR_WEIGHT>
329.3472

> <EXACT_MASS>
329.126322723

> <JCHEM_ACCEPTOR_COUNT>
5

> <JCHEM_AVERAGE_POLARIZABILITY>
34.89731532490157

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
4

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
(2E)-N-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide

> <ALOGPS_LOGP>
1.61

> <JCHEM_LOGP>
1.8821559783333335

> <ALOGPS_LOGS>
-3.84

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
2

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
10.029417082070074

> <JCHEM_PKA_STRONGEST_ACIDIC>
9.330861405653769

> <JCHEM_PKA_STRONGEST_BASIC>
1.1077493318425116

> <JCHEM_POLAR_SURFACE_AREA>
99.02000000000001

> <JCHEM_REFRACTIVITY>
90.7789

> <JCHEM_ROTATABLE_BOND_COUNT>
6

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
4.75e-02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
(2E)-N-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide

> <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  C   UNK     0      -6.079   1.612   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -7.314   0.842   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -7.314  -0.698   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -6.079  -1.468   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      -4.693  -0.698   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -4.693   0.842   0.000  0.00  0.00           C+0
HETATM    7  O   UNK     0      -8.700   1.612   0.000  0.00  0.00           O+0
HETATM    8  N   UNK     0      -1.921   0.842   0.000  0.00  0.00           N+0
HETATM    9  C   UNK     0      -2.075  -0.698   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      -3.307  -1.468   0.000  0.00  0.00           C+0
HETATM   11  O   UNK     0      -3.307  -3.008   0.000  0.00  0.00           O+0
HETATM   12  C   UNK     0      -0.517   1.476   0.000  0.00  0.00           C+0
HETATM   13  O   UNK     0      -0.363   3.008   0.000  0.00  0.00           O+0
HETATM   14  C   UNK     0       0.733   0.577   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       2.137   1.211   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       3.387   0.313   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       3.238  -1.222   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       4.490  -2.120   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       5.895  -1.486   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       6.046   0.046   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       4.791   0.945   0.000  0.00  0.00           C+0
HETATM   22  O   UNK     0       7.144  -2.384   0.000  0.00  0.00           O+0
HETATM   23  O   UNK     0       7.447   0.683   0.000  0.00  0.00           O+0
HETATM   24  C   UNK     0       8.700  -0.213   0.000  0.00  0.00           C+0
CONECT    1    2    6                                                       
CONECT    2    1    3    7                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5                                                       
CONECT    5    4    6   10                                                  
CONECT    6    1    5                                                       
CONECT    7    2                                                            
CONECT    8    9   12                                                       
CONECT    9    8   10                                                       
CONECT   10    5    9   11                                                  
CONECT   11   10                                                            
CONECT   12    8   13   14                                                  
CONECT   13   12                                                            
CONECT   14   12   15                                                       
CONECT   15   14   16                                                       
CONECT   16   15   17   21                                                  
CONECT   17   16   18                                                       
CONECT   18   17   19                                                       
CONECT   19   18   20   22                                                  
CONECT   20   19   21   23                                                  
CONECT   21   16   20                                                       
CONECT   22   19                                                            
CONECT   23   20   24                                                       
CONECT   24   23                                                            
MASTER        0    0    0    0    0    0    0    0   24    0   50    0
END

View in JSmol

Synonyms

Value	Source
N-cis-Feruloyloctopamine	HMDB
N-Feruloyloctopamine	HMDB
(2E)-N-[2-Hydroxy-2-(4-hydroxyphenyl)ethyl]-3-(4-hydroxy-3-methoxyphenyl)prop-2-enimidate	Generator
N-trans-Feruloyloctopamine	MeSH

Chemical Formula

C₁₈H₁₉NO₅

Average Mass

329.3472 Da

Monoisotopic Mass

329.12632 Da

IUPAC Name

(2E)-N-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide

Traditional Name

(2E)-N-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide

CAS Registry Number

Not Available

SMILES

COC1=CC(\C=C\C(=O)NCC(O)C2=CC=C(O)C=C2)=CC=C1O

InChI Identifier

InChI=1S/C18H19NO5/c1-24-17-10-12(2-8-15(17)21)3-9-18(23)19-11-16(22)13-4-6-14(20)7-5-13/h2-10,16,20-22H,11H2,1H3,(H,19,23)/b9-3+

InChI Key

VJSCHQMOTSXAKB-YCRREMRBSA-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
Allium sativum	LOTUS Database	35616633
Antidesma membranaceum	LOTUS Database	35616633
Corydalis sempervirens	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as hydroxycinnamic acids and derivatives. Hydroxycinnamic acids and derivatives are compounds containing an cinnamic acid (or a derivative thereof) where the benzene ring is hydroxylated.

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Cinnamic acids and derivatives

Sub Class

Hydroxycinnamic acids and derivatives

Direct Parent

Hydroxycinnamic acids and derivatives

Alternative Parents

Substituents

Cinnamic acid amide
Hydroxycinnamic acid or derivatives
Methoxyphenol
Anisole
Phenoxy compound
Phenol ether
Styrene
Methoxybenzene
Alkyl aryl ether
1-hydroxy-2-unsubstituted benzenoid
Phenol
Benzenoid
Monocyclic benzene moiety
Secondary carboxylic acid amide
Secondary alcohol
Carboxamide group
Carboxylic acid derivative
Ether
Organic oxygen compound
Aromatic alcohol
Organic nitrogen compound
Organic oxide
Organooxygen compound
Carbonyl group
Alcohol
Hydrocarbon derivative
Organopnictogen compound
Organonitrogen compound
Aromatic homomonocyclic compound

Molecular Framework

Aromatic homomonocyclic 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	1.61	ALOGPS
logP	1.88	ChemAxon
logS	-3.8	ALOGPS
pKa (Strongest Acidic)	9.33	ChemAxon
pKa (Strongest Basic)	1.11	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	5	ChemAxon
Hydrogen Donor Count	4	ChemAxon
Polar Surface Area	99.02 Å²	ChemAxon
Rotatable Bond Count	6	ChemAxon
Refractivity	90.78 m³·mol⁻¹	ChemAxon
Polarizability	34.9 Å³	ChemAxon
Number of Rings	2	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	Yes	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

External Links

HMDB ID

HMDB0032805

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

FDB010779

KNApSAcK ID

C00035344

Chemspider ID

22913041

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

24096391

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Not Available

Showing NP-Card for N-Feruloyloctopamine (NP0137429)

MOL for NP0137429 (N-Feruloyloctopamine)

3D MOL for NP0137429 (N-Feruloyloctopamine)

3D SDF for NP0137429 (N-Feruloyloctopamine)

3D-SDF for NP0137429 (N-Feruloyloctopamine)

PDB for NP0137429 (N-Feruloyloctopamine)

3D PDB for NP0137429 (N-Feruloyloctopamine)

SMILES for NP0137429 (N-Feruloyloctopamine)

INCHI for NP0137429 (N-Feruloyloctopamine)

Structure for NP0137429 (N-Feruloyloctopamine)

3D Structure for NP0137429 (N-Feruloyloctopamine)