NP-MRD: Showing NP-Card for (6e)-3,4-dihydroxy-n-(2-hydroxy-4,5,6,7-tetrahydro-3h-azepin-3-yl)-2-methoxy-8-methyl-5-(tetradecanoyloxy)non-6-enimidic acid (NP0247092)

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Record Information

Version

2.0

Created at

2022-09-07 08:46:57 UTC

Updated at

2022-09-07 08:46:58 UTC

NP-MRD ID

NP0247092

Secondary Accession Numbers

None

Natural Product Identification

Common Name

(6e)-3,4-dihydroxy-n-(2-hydroxy-4,5,6,7-tetrahydro-3h-azepin-3-yl)-2-methoxy-8-methyl-5-(tetradecanoyloxy)non-6-enimidic acid

Description

NSC646847 belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. N-acyl-alpha amino acids and derivatives are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom. (6e)-3,4-dihydroxy-n-(2-hydroxy-4,5,6,7-tetrahydro-3h-azepin-3-yl)-2-methoxy-8-methyl-5-(tetradecanoyloxy)non-6-enimidic acid is found in Rhabdastrella globostellata. Based on a literature review very few articles have been published on NSC646847.

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1652309072210462D          

 40 40  0  0  0  0            999 V2000
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M  END

     RDKit          3D

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M  END


  Mrv1652309072210462D          

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    9.1216  -14.6035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8742  -14.2655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5432  -14.7483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2958  -14.4104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9648  -14.8932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7174  -14.5552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3864  -15.0380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3028  -15.8587    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1390  -14.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8080  -15.1828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7243  -16.0036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3933  -16.4864    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3097  -17.3071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9787  -17.7899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5571  -17.6451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5606  -14.8449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6442  -14.0241    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2296  -15.3277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1459  -16.1484    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.9822  -14.9897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0658  -14.1690    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.8184  -13.8310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6511  -15.4725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5675  -16.2933    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.4037  -15.1345    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   19.0727  -15.6173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.7980  -15.2241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.5576  -15.5459    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.7796  -16.3405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.2968  -17.0095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.4728  -17.0491    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   18.9280  -16.4296    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1334  -16.6516    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
  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
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 14 16  1  0  0  0  0
 16 17  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
 20 21  1  0  0  0  0
 20 22  1  0  0  0  0
 17 23  1  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  0  0  0  0
 25 26  1  0  0  0  0
 25 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 27 30  1  0  0  0  0
 30 31  1  0  0  0  0
 30 32  2  0  0  0  0
 32 33  1  4  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 36 37  1  0  0  0  0
 37 38  1  0  0  0  0
 38 39  2  0  0  0  0
 33 39  1  0  0  0  0
 39 40  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0247092

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CCCCCCCCCCCCCC(=O)OC(\C=C\C(C)C)C(O)C(O)C(OC)C(O)=NC1CCCCN=C1O

> <INCHI_IDENTIFIER>
InChI=1S/C31H56N2O7/c1-5-6-7-8-9-10-11-12-13-14-15-19-26(34)40-25(21-20-23(2)3)27(35)28(36)29(39-4)31(38)33-24-18-16-17-22-32-30(24)37/h20-21,23-25,27-29,35-36H,5-19,22H2,1-4H3,(H,32,37)(H,33,38)/b21-20+

> <INCHI_KEY>
ZVRFWGNDDYSRLF-QZQOTICOSA-N

> <FORMULA>
C31H56N2O7

> <MOLECULAR_WEIGHT>
568.796

> <EXACT_MASS>
568.408752151

> <JCHEM_ACCEPTOR_COUNT>
8

> <JCHEM_ATOM_COUNT>
96

> <JCHEM_AVERAGE_POLARIZABILITY>
66.57956558533634

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
4

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(6E)-3,4-dihydroxy-N-(7-hydroxy-3,4,5,6-tetrahydro-2H-azepin-6-yl)-2-methoxy-8-methyl-5-(tetradecanoyloxy)non-6-enimidic acid

> <JCHEM_LOGP>
4.107546029313079

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
3.5248522592272313

> <JCHEM_PKA_STRONGEST_ACIDIC>
-4.572662804622486

> <JCHEM_PKA_STRONGEST_BASIC>
12.06197673645129

> <JCHEM_POLAR_SURFACE_AREA>
141.17000000000002

> <JCHEM_REFRACTIVITY>
157.5582

> <JCHEM_ROTATABLE_BOND_COUNT>
22

> <JCHEM_RULE_OF_FIVE>
0

> <JCHEM_TRADITIONAL_IUPAC>
(6E)-3,4-dihydroxy-N-(2-hydroxy-4,5,6,7-tetrahydro-3H-azepin-3-yl)-2-methoxy-8-methyl-5-(tetradecanoyloxy)non-6-enimidic acid

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 07-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   07-SEP-22         0                                  
HETATM    1  C   UNK     0       7.817 -25.548   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       9.066 -26.449   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      10.471 -25.818   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      11.720 -26.719   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      13.125 -26.088   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      14.373 -26.989   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      15.778 -26.359   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      17.027 -27.260   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      18.432 -26.629   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      19.681 -27.530   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      21.086 -26.899   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      22.334 -27.801   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      23.739 -27.170   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      24.988 -28.071   0.000  0.00  0.00           C+0
HETATM   15  O   UNK     0      24.832 -29.603   0.000  0.00  0.00           O+0
HETATM   16  O   UNK     0      26.393 -27.440   0.000  0.00  0.00           O+0
HETATM   17  C   UNK     0      27.642 -28.341   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      27.485 -29.873   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      28.734 -30.775   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      28.578 -32.307   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      29.827 -33.208   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      27.173 -32.937   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      29.046 -27.710   0.000  0.00  0.00           C+0
HETATM   24  O   UNK     0      29.202 -26.178   0.000  0.00  0.00           O+0
HETATM   25  C   UNK     0      30.295 -28.612   0.000  0.00  0.00           C+0
HETATM   26  O   UNK     0      30.139 -30.144   0.000  0.00  0.00           O+0
HETATM   27  C   UNK     0      31.700 -27.981   0.000  0.00  0.00           C+0
HETATM   28  O   UNK     0      31.856 -26.449   0.000  0.00  0.00           O+0
HETATM   29  C   UNK     0      33.261 -25.818   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0      32.949 -28.882   0.000  0.00  0.00           C+0
HETATM   31  O   UNK     0      32.793 -30.414   0.000  0.00  0.00           O+0
HETATM   32  N   UNK     0      34.354 -28.251   0.000  0.00  0.00           N+0
HETATM   33  C   UNK     0      35.602 -29.152   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0      36.956 -28.418   0.000  0.00  0.00           C+0
HETATM   35  C   UNK     0      38.374 -29.019   0.000  0.00  0.00           C+0
HETATM   36  C   UNK     0      38.789 -30.502   0.000  0.00  0.00           C+0
HETATM   37  C   UNK     0      37.887 -31.751   0.000  0.00  0.00           C+0
HETATM   38  N   UNK     0      36.349 -31.825   0.000  0.00  0.00           N+0
HETATM   39  C   UNK     0      35.332 -30.668   0.000  0.00  0.00           C+0
HETATM   40  O   UNK     0      33.849 -31.083   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                                                       
CONECT    8    7    9                                                       
CONECT    9    8   10                                                       
CONECT   10    9   11                                                       
CONECT   11   10   12                                                       
CONECT   12   11   13                                                       
CONECT   13   12   14                                                       
CONECT   14   13   15   16                                                  
CONECT   15   14                                                            
CONECT   16   14   17                                                       
CONECT   17   16   18   23                                                  
CONECT   18   17   19                                                       
CONECT   19   18   20                                                       
CONECT   20   19   21   22                                                  
CONECT   21   20                                                            
CONECT   22   20                                                            
CONECT   23   17   24   25                                                  
CONECT   24   23                                                            
CONECT   25   23   26   27                                                  
CONECT   26   25                                                            
CONECT   27   25   28   30                                                  
CONECT   28   27   29                                                       
CONECT   29   28                                                            
CONECT   30   27   31   32                                                  
CONECT   31   30                                                            
CONECT   32   30   33                                                       
CONECT   33   32   34   39                                                  
CONECT   34   33   35                                                       
CONECT   35   34   36                                                       
CONECT   36   35   37                                                       
CONECT   37   36   38                                                       
CONECT   38   37   39                                                       
CONECT   39   38   33   40                                                  
CONECT   40   39                                                            
MASTER        0    0    0    0    0    0    0    0   40    0   80    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₃₁H₅₆N₂O₇

Average Mass

568.7960 Da

Monoisotopic Mass

568.40875 Da

IUPAC Name

(6E)-3,4-dihydroxy-N-(7-hydroxy-3,4,5,6-tetrahydro-2H-azepin-6-yl)-2-methoxy-8-methyl-5-(tetradecanoyloxy)non-6-enimidic acid

Traditional Name

(6E)-3,4-dihydroxy-N-(2-hydroxy-4,5,6,7-tetrahydro-3H-azepin-3-yl)-2-methoxy-8-methyl-5-(tetradecanoyloxy)non-6-enimidic acid

CAS Registry Number

Not Available

SMILES

CCCCCCCCCCCCCC(=O)OC(\C=C\C(C)C)C(O)C(O)C(OC)C(O)=NC1CCCCN=C1O

InChI Identifier

InChI=1S/C31H56N2O7/c1-5-6-7-8-9-10-11-12-13-14-15-19-26(34)40-25(21-20-23(2)3)27(35)28(36)29(39-4)31(38)33-24-18-16-17-22-32-30(24)37/h20-21,23-25,27-29,35-36H,5-19,22H2,1-4H3,(H,32,37)(H,33,38)/b21-20+

InChI Key

ZVRFWGNDDYSRLF-QZQOTICOSA-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
Rhabdastrella globostellata	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. N-acyl-alpha amino acids and derivatives are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.

Kingdom

Organic compounds

Super Class

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Sub Class

Amino acids, peptides, and analogues

Direct Parent

N-acyl-alpha amino acids and derivatives

Alternative Parents

Substituents

N-acyl-alpha amino acid or derivatives
Caprolactam
Azepane
Fatty acid ester
Fatty amide
Monosaccharide
N-acyl-amine
Fatty acyl
1,2-diol
Carboxamide group
Carboxylic acid ester
Lactam
Secondary alcohol
Secondary carboxylic acid amide
Monocarboxylic acid or derivatives
Ether
Dialkyl ether
Azacycle
Organoheterocyclic compound
Hydrocarbon derivative
Organic nitrogen compound
Organic oxide
Organopnictogen compound
Alcohol
Organonitrogen compound
Organooxygen compound
Organic oxygen compound
Carbonyl group
Aliphatic heteromonocyclic compound

Molecular Framework

Aliphatic heteromonocyclic 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	4.11	ChemAxon
pKa (Strongest Acidic)	-4.6	ChemAxon
pKa (Strongest Basic)	12.06	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	8	ChemAxon
Hydrogen Donor Count	4	ChemAxon
Polar Surface Area	141.17 Å²	ChemAxon
Rotatable Bond Count	22	ChemAxon
Refractivity	157.56 m³·mol⁻¹	ChemAxon
Polarizability	66.58 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

4578110

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

5467019

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

LOTUS database [Link]

Showing NP-Card for (6e)-3,4-dihydroxy-n-(2-hydroxy-4,5,6,7-tetrahydro-3h-azepin-3-yl)-2-methoxy-8-methyl-5-(tetradecanoyloxy)non-6-enimidic acid (NP0247092)

MOL for NP0247092 ((6e)-3,4-dihydroxy-n-(2-hydroxy-4,5,6,7-tetrahydro-3h-azepin-3-yl)-2-methoxy-8-methyl-5-(tetradecanoyloxy)non-6-enimidic acid)

3D MOL for NP0247092 ((6e)-3,4-dihydroxy-n-(2-hydroxy-4,5,6,7-tetrahydro-3h-azepin-3-yl)-2-methoxy-8-methyl-5-(tetradecanoyloxy)non-6-enimidic acid)

3D SDF for NP0247092 ((6e)-3,4-dihydroxy-n-(2-hydroxy-4,5,6,7-tetrahydro-3h-azepin-3-yl)-2-methoxy-8-methyl-5-(tetradecanoyloxy)non-6-enimidic acid)

3D-SDF for NP0247092 ((6e)-3,4-dihydroxy-n-(2-hydroxy-4,5,6,7-tetrahydro-3h-azepin-3-yl)-2-methoxy-8-methyl-5-(tetradecanoyloxy)non-6-enimidic acid)

PDB for NP0247092 ((6e)-3,4-dihydroxy-n-(2-hydroxy-4,5,6,7-tetrahydro-3h-azepin-3-yl)-2-methoxy-8-methyl-5-(tetradecanoyloxy)non-6-enimidic acid)

3D PDB for NP0247092 ((6e)-3,4-dihydroxy-n-(2-hydroxy-4,5,6,7-tetrahydro-3h-azepin-3-yl)-2-methoxy-8-methyl-5-(tetradecanoyloxy)non-6-enimidic acid)

SMILES for NP0247092 ((6e)-3,4-dihydroxy-n-(2-hydroxy-4,5,6,7-tetrahydro-3h-azepin-3-yl)-2-methoxy-8-methyl-5-(tetradecanoyloxy)non-6-enimidic acid)

INCHI for NP0247092 ((6e)-3,4-dihydroxy-n-(2-hydroxy-4,5,6,7-tetrahydro-3h-azepin-3-yl)-2-methoxy-8-methyl-5-(tetradecanoyloxy)non-6-enimidic acid)

Structure for NP0247092 ((6e)-3,4-dihydroxy-n-(2-hydroxy-4,5,6,7-tetrahydro-3h-azepin-3-yl)-2-methoxy-8-methyl-5-(tetradecanoyloxy)non-6-enimidic acid)

3D Structure for NP0247092 ((6e)-3,4-dihydroxy-n-(2-hydroxy-4,5,6,7-tetrahydro-3h-azepin-3-yl)-2-methoxy-8-methyl-5-(tetradecanoyloxy)non-6-enimidic acid)