NP-MRD: Showing NP-Card for [(8r,9r,10r,12r)-4-formyl-6,9-dihydroxy-14-oxa-1,11-diazatetracyclo[7.4.1.0²,⁷.0¹⁰,¹²]tetradeca-2,4,6-trien-8-yl]methoxycarboximidic acid (NP0165244)

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Record Information

Version

2.0

Created at

2022-09-03 00:18:57 UTC

Updated at

2022-09-03 00:18:57 UTC

NP-MRD ID

NP0165244

Secondary Accession Numbers

None

Natural Product Identification

Common Name

[(8r,9r,10r,12r)-4-formyl-6,9-dihydroxy-14-oxa-1,11-diazatetracyclo[7.4.1.0²,⁷.0¹⁰,¹²]tetradeca-2,4,6-trien-8-yl]methoxycarboximidic acid

Description

Antibiotic FR 900482 belongs to the class of organic compounds known as 1-hydroxylamino, 4-unsubstituted benzenoids. These are benzenoids in which the benzene moiety is N-linked to an hydroxylamine at the 1-position, and unsubstituted at the 4-position. Based on a literature review very few articles have been published on Antibiotic FR 900482.

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 38 41  0  0  0  0  0  0  0  0999 V2000
   -3.8259   -2.9056    1.1757 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2702   -2.3474    0.5051 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6652   -1.2753   -0.0813 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9230   -0.7876    0.1692 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8170   -0.6365   -0.9507 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4344   -0.8748   -1.0470 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7965   -0.5456    0.2874 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.6598   -0.7748    0.2753 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3209   -1.8882   -0.1402 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5936   -2.9931   -0.5672 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7239   -1.9160   -0.1348 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4731   -0.8280    0.2872 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9287   -0.8650    0.2861 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4886   -1.9176   -0.1107 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8049    0.2985    0.7091 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4460    0.3229    0.7046 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7595    1.4627    1.1425 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0871    2.7617    0.7671 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1671    3.0098   -0.1783 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.0555    1.9647   -1.2687 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0705    1.9223   -0.2677 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.1946    0.8302    0.7253 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.4763    0.7579    1.2719 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3975    1.2196    1.8606 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7210   -1.4028    0.0325 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3198   -1.9582   -1.2218 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0347   -0.2565   -1.8672 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2245   -1.2607    1.0260 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9657   -3.8515   -0.8892 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1787   -2.8335   -0.4782 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5404   -0.0522    0.6017 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3005    1.2235    1.0453 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9226    2.9549    0.1302 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9606    3.4748    1.6039 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3434    4.0206   -0.4533 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2389    2.3191   -2.2226 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0887    2.2093   -0.6915 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0901    1.4181    0.8439 H   0  0  0  0  0  0  0  0  0  0  0  0
  4  3  1  0
  3  2  2  0
  3  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
  9 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 12 15  1  0
 15 16  2  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  1  1
 22 24  1  0
 22  7  1  0
 16  8  1  0
 24 17  1  0
 21 19  1  0
  4 25  1  0
  2  1  1  0
  6 26  1  0
  6 27  1  0
  7 28  1  1
 10 29  1  0
 11 30  1  0
 13 31  1  0
 15 32  1  0
 18 33  1  0
 18 34  1  0
 19 35  1  6
 20 36  1  0
 21 37  1  6
 23 38  1  0
M  END


  Mrv1652309032202182D          

 23 26  0  0  1  0            999 V2000
    2.6667    2.5315    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.1645    1.8769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3466    1.9846    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4802    1.1147    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9780    0.4602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2937   -0.3020    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.7103   -0.8853    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9959   -0.4728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9959    0.3522    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2814   -0.8853    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2814   -1.7103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4331   -2.1228    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4331   -2.9478    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9959   -2.1228    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7103   -1.7103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2937   -2.2937    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1187   -2.2937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7021   -1.7103    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.4165   -1.2978    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7021   -0.8853    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.1187   -0.3020    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.4344    0.4602    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4572   -1.1947    0.0000 O   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
  2  4  1  0  0  0  0
  4  5  1  0  0  0  0
  6  5  1  6  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 11 14  1  0  0  0  0
 14 15  2  0  0  0  0
  7 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  6  0  0  0
 20 19  1  6  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
  6 21  1  0  0  0  0
 21 22  1  1  0  0  0
 21 23  1  0  0  0  0
 16 23  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0165244

> <DATABASE_NAME>
NP-MRD

> <SMILES>
OC(=N)OC[C@H]1C2=C(O)C=C(C=O)C=C2N2C[C@H]3N[C@H]3[C@]1(O)O2

> <INCHI_IDENTIFIER>
InChI=1S/C14H15N3O6/c15-13(20)22-5-7-11-9(1-6(4-18)2-10(11)19)17-3-8-12(16-8)14(7,21)23-17/h1-2,4,7-8,12,16,19,21H,3,5H2,(H2,15,20)/t7-,8+,12+,14+/m0/s1

> <INCHI_KEY>
XVPSPMLUMQEEIU-PWLJWKHCSA-N

> <FORMULA>
C14H15N3O6

> <MOLECULAR_WEIGHT>
321.289

> <EXACT_MASS>
321.096085215

> <JCHEM_ACCEPTOR_COUNT>
9

> <JCHEM_ATOM_COUNT>
38

> <JCHEM_AVERAGE_POLARIZABILITY>
29.777936893867626

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
5

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
{[(8R,9R,10R,12R)-4-formyl-6,9-dihydroxy-14-oxa-1,11-diazatetracyclo[7.4.1.0^{2,7}.0^{10,12}]tetradeca-2,4,6-trien-8-yl]methoxy}carboximidic acid

> <ALOGPS_LOGP>
-0.41

> <JCHEM_LOGP>
-1.8716121413619018

> <ALOGPS_LOGS>
-2.27

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
4

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
9.006171700630501

> <JCHEM_PKA_STRONGEST_ACIDIC>
-3.416987501087057

> <JCHEM_PKA_STRONGEST_BASIC>
11.178891047286584

> <JCHEM_POLAR_SURFACE_AREA>
145.25

> <JCHEM_REFRACTIVITY>
97.60000000000001

> <JCHEM_ROTATABLE_BOND_COUNT>
4

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
1.74e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
[(8R,9R,10R,12R)-4-formyl-6,9-dihydroxy-14-oxa-1,11-diazatetracyclo[7.4.1.0^{2,7}.0^{10,12}]tetradeca-2,4,6-trien-8-yl]methoxycarboximidic acid

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 03-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   03-SEP-22         0                                  
HETATM    1  N   UNK     0       4.978   4.725   0.000  0.00  0.00           N+0
HETATM    2  C   UNK     0       4.040   3.504   0.000  0.00  0.00           C+0
HETATM    3  O   UNK     0       2.514   3.705   0.000  0.00  0.00           O+0
HETATM    4  O   UNK     0       4.630   2.081   0.000  0.00  0.00           O+0
HETATM    5  C   UNK     0       3.692   0.859   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       4.282  -0.564   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       3.193  -1.653   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       1.859  -0.883   0.000  0.00  0.00           C+0
HETATM    9  O   UNK     0       1.859   0.657   0.000  0.00  0.00           O+0
HETATM   10  C   UNK     0       0.525  -1.653   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       0.525  -3.193   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      -0.808  -3.963   0.000  0.00  0.00           C+0
HETATM   13  O   UNK     0      -0.808  -5.503   0.000  0.00  0.00           O+0
HETATM   14  C   UNK     0       1.859  -3.963   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       3.193  -3.193   0.000  0.00  0.00           C+0
HETATM   16  N   UNK     0       4.282  -4.282   0.000  0.00  0.00           N+0
HETATM   17  C   UNK     0       5.822  -4.282   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       6.911  -3.193   0.000  0.00  0.00           C+0
HETATM   19  N   UNK     0       8.244  -2.423   0.000  0.00  0.00           N+0
HETATM   20  C   UNK     0       6.911  -1.653   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       5.822  -0.564   0.000  0.00  0.00           C+0
HETATM   22  O   UNK     0       6.411   0.859   0.000  0.00  0.00           O+0
HETATM   23  O   UNK     0       4.587  -2.230   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3    4                                                  
CONECT    3    2                                                            
CONECT    4    2    5                                                       
CONECT    5    4    6                                                       
CONECT    6    5    7   21                                                  
CONECT    7    6    8   15                                                  
CONECT    8    7    9   10                                                  
CONECT    9    8                                                            
CONECT   10    8   11                                                       
CONECT   11   10   12   14                                                  
CONECT   12   11   13                                                       
CONECT   13   12                                                            
CONECT   14   11   15                                                       
CONECT   15   14    7   16                                                  
CONECT   16   15   17   23                                                  
CONECT   17   16   18                                                       
CONECT   18   17   19   20                                                  
CONECT   19   18   20                                                       
CONECT   20   19   18   21                                                  
CONECT   21   20    6   22   23                                             
CONECT   22   21                                                            
CONECT   23   21   16                                                       
MASTER        0    0    0    0    0    0    0    0   23    0   52    0
END

View in JSmol

Synonyms

Value	Source
4-Formyl-6,9-dihydroxy-14-oxa-1,11-diazatetracyclo(7.4.1.o(2,7).o(10,12))tetradeca-2,4,6-triene-8-ylmethyl carbamate	MeSH

Chemical Formula

C₁₄H₁₅N₃O₆

Average Mass

321.2890 Da

Monoisotopic Mass

321.09609 Da

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

OC(=N)OC[C@H]1C2=C(O)C=C(C=O)C=C2N2C[C@H]3N[C@H]3[C@]1(O)O2

InChI Identifier

InChI=1S/C14H15N3O6/c15-13(20)22-5-7-11-9(1-6(4-18)2-10(11)19)17-3-8-12(16-8)14(7,21)23-17/h1-2,4,7-8,12,16,19,21H,3,5H2,(H2,15,20)/t7-,8+,12+,14+/m0/s1

InChI Key

XVPSPMLUMQEEIU-PWLJWKHCSA-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

Not Available

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as 1-hydroxylamino, 4-unsubstituted benzenoids. These are benzenoids in which the benzene moiety is N-linked to an hydroxylamine at the 1-position, and unsubstituted at the 4-position.

Kingdom

Organic compounds

Super Class

Benzenoids

Class

1-hydroxylamino, 4-unsubstituted benzenoids

Sub Class

Not Available

Direct Parent

1-hydroxylamino, 4-unsubstituted benzenoids

Alternative Parents

Substituents

1-hydroxylamino, 4-unsubstituted benzenoid
1-hydroxylamino, 2-unsubstituted benzenoid
1-hydroxy-4-unsubstituted benzenoid
1-hydroxy-2-unsubstituted benzenoid
Aralkylamine
Aryl-aldehyde
Oxazinane
1,2-oxazinane
Carbamic acid ester
Carbonic acid derivative
Oxacycle
Azacycle
N-organohydroxylamine
Organoheterocyclic compound
Secondary amine
Secondary aliphatic amine
Aziridine
Organic nitrogen compound
Organic oxygen compound
Organopnictogen compound
Organic oxide
Hydrocarbon derivative
Organooxygen compound
Organonitrogen compound
Carbonyl group
Amine
Aldehyde
Aromatic heteropolycyclic compound

Molecular Framework

Aromatic heteropolycyclic 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	-0.41	ALOGPS
logS	-2.3	ALOGPS

External Links

HMDB ID

Not Available

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

Not Available

KNApSAcK ID

C00017861

Chemspider ID

115456

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

130513

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

LOTUS database [Link]

Showing NP-Card for [(8r,9r,10r,12r)-4-formyl-6,9-dihydroxy-14-oxa-1,11-diazatetracyclo[7.4.1.0²,⁷.0¹⁰,¹²]tetradeca-2,4,6-trien-8-yl]methoxycarboximidic acid (NP0165244)

MOL for NP0165244 ([(8r,9r,10r,12r)-4-formyl-6,9-dihydroxy-14-oxa-1,11-diazatetracyclo[7.4.1.0²,⁷.0¹⁰,¹²]tetradeca-2,4,6-trien-8-yl]methoxycarboximidic acid)

3D MOL for NP0165244 ([(8r,9r,10r,12r)-4-formyl-6,9-dihydroxy-14-oxa-1,11-diazatetracyclo[7.4.1.0²,⁷.0¹⁰,¹²]tetradeca-2,4,6-trien-8-yl]methoxycarboximidic acid)

3D SDF for NP0165244 ([(8r,9r,10r,12r)-4-formyl-6,9-dihydroxy-14-oxa-1,11-diazatetracyclo[7.4.1.0²,⁷.0¹⁰,¹²]tetradeca-2,4,6-trien-8-yl]methoxycarboximidic acid)

3D-SDF for NP0165244 ([(8r,9r,10r,12r)-4-formyl-6,9-dihydroxy-14-oxa-1,11-diazatetracyclo[7.4.1.0²,⁷.0¹⁰,¹²]tetradeca-2,4,6-trien-8-yl]methoxycarboximidic acid)

PDB for NP0165244 ([(8r,9r,10r,12r)-4-formyl-6,9-dihydroxy-14-oxa-1,11-diazatetracyclo[7.4.1.0²,⁷.0¹⁰,¹²]tetradeca-2,4,6-trien-8-yl]methoxycarboximidic acid)

3D PDB for NP0165244 ([(8r,9r,10r,12r)-4-formyl-6,9-dihydroxy-14-oxa-1,11-diazatetracyclo[7.4.1.0²,⁷.0¹⁰,¹²]tetradeca-2,4,6-trien-8-yl]methoxycarboximidic acid)

SMILES for NP0165244 ([(8r,9r,10r,12r)-4-formyl-6,9-dihydroxy-14-oxa-1,11-diazatetracyclo[7.4.1.0²,⁷.0¹⁰,¹²]tetradeca-2,4,6-trien-8-yl]methoxycarboximidic acid)

INCHI for NP0165244 ([(8r,9r,10r,12r)-4-formyl-6,9-dihydroxy-14-oxa-1,11-diazatetracyclo[7.4.1.0²,⁷.0¹⁰,¹²]tetradeca-2,4,6-trien-8-yl]methoxycarboximidic acid)

Structure for NP0165244 ([(8r,9r,10r,12r)-4-formyl-6,9-dihydroxy-14-oxa-1,11-diazatetracyclo[7.4.1.0²,⁷.0¹⁰,¹²]tetradeca-2,4,6-trien-8-yl]methoxycarboximidic acid)

3D Structure for NP0165244 ([(8r,9r,10r,12r)-4-formyl-6,9-dihydroxy-14-oxa-1,11-diazatetracyclo[7.4.1.0²,⁷.0¹⁰,¹²]tetradeca-2,4,6-trien-8-yl]methoxycarboximidic acid)