NP-MRD: Showing NP-Card for 14-methyl-11-oxa-5-azapentacyclo[7.4.3.1¹⁰,¹³.0¹,¹⁶.0⁵,¹⁶]heptadec-3-ene-2,12-dione (NP0293839)

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Record Information

Version

2.0

Created at

2022-09-10 02:04:41 UTC

Updated at

2022-09-10 02:04:42 UTC

NP-MRD ID

NP0293839

Secondary Accession Numbers

None

Natural Product Identification

Common Name

14-methyl-11-oxa-5-azapentacyclo[7.4.3.1¹⁰,¹³.0¹,¹⁶.0⁵,¹⁶]heptadec-3-ene-2,12-dione

Description

14-Methyl-11-oxa-5-azapentacyclo[7.4.3.1¹⁰,¹³.0¹,¹⁶.0⁵,¹⁶]Heptadec-3-ene-2,12-dione belongs to the class of organic compounds known as quinolidines. These are organic compounds containing a quinolidine or decahydroquinoline moiety, which is a bicyclic skeleton consisting of a piperidine fused to a cyclohexane ring. 14-Methyl-11-oxa-5-azapentacyclo[7.4.3.1¹⁰,¹³.0¹,¹⁶.0⁵,¹⁶]Heptadec-3-ene-2,12-dione is an extremely weak basic (essentially neutral) compound (based on its pKa).

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 39 43  0  0  0  0  0  0  0  0999 V2000
   -2.7320   -1.8072    0.6991 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7411   -0.6949    0.9073 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.3833   -1.1088    1.3769 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2093   -0.1826    0.3038 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.7680    1.0846    0.8041 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.2307    1.1891    0.3757 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0251   -0.0010    0.8432 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4110   -1.2869    0.3967 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2256   -0.9618   -0.4087 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1142   -1.3791   -1.7387 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0884   -1.4370   -2.2828 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2447   -1.0718   -1.4987 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3621   -1.5312   -1.7985 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1177   -0.1598   -0.3458 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.5929    1.2158   -0.7528 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.4084    2.2394    0.3382 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1003    2.3402    0.3515 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.3499    2.4497   -1.0638 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6103    1.7207   -1.7424 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6341    1.5290   -2.9718 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1341   -2.0646    1.7245 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3222   -2.6985    0.2177 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6087   -1.3871    0.1654 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1734    0.0423    1.6113 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2216   -2.1850    1.2011 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1112   -0.8022    2.4088 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7713    1.0897    1.9219 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7029    2.1052    0.7645 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2427    1.1846   -0.7332 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1221    0.0828    1.9518 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0352    0.0817    0.4209 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0950   -1.9475   -0.1679 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0187   -1.8056    1.3080 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0079   -1.6431   -2.2883 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1517   -1.7637   -3.3166 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6114    1.1489   -1.1293 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7900    3.2001   -0.0487 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8667    2.0226    1.2889 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4763    3.1931    0.9067 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  4  3  1  1
  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  2  0
 11 12  1  0
 12 13  2  0
 14 12  1  6
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  2  0
 14  2  1  0
 19 15  1  0
  9  4  1  0
 14  4  1  0
 17  5  1  0
  1 21  1  0
  1 22  1  0
  1 23  1  0
  2 24  1  1
  3 25  1  0
  3 26  1  0
  5 27  1  1
  6 28  1  0
  6 29  1  0
  7 30  1  0
  7 31  1  0
  8 32  1  0
  8 33  1  0
 10 34  1  0
 11 35  1  0
 15 36  1  6
 16 37  1  0
 16 38  1  0
 17 39  1  1
M  END


  Mrv1533004231520232D          

 20 24  0  0  0  0            999 V2000
    0.8699   -1.7866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3575   -1.1211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2136   -0.3896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9888   -0.1620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7021    0.3708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5729    1.1979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8121    1.5263    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1436    1.0321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1965    0.1877    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5343   -0.4334    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6829   -1.2930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5059   -1.6408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6502   -2.4531    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1587   -1.0309    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0163   -1.2831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2406   -0.5798    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5346    0.0562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2098   -0.5081    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8899   -1.3288    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3374   -2.0219    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
  4  9  1  0  0  0  0
  9 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
 12 14  1  0  0  0  0
  2 14  1  0  0  0  0
  4 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
  5 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 15 19  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
> <DATABASE_ID>
NP0293839

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CC1CC23C4CCCN2C=CC(=O)C13C1CC4OC1=O

> <INCHI_IDENTIFIER>
InChI=1S/C16H19NO3/c1-9-8-15-10-3-2-5-17(15)6-4-13(18)16(9,15)11-7-12(10)20-14(11)19/h4,6,9-12H,2-3,5,7-8H2,1H3

> <INCHI_KEY>
GBFAZBCNZLUZBE-UHFFFAOYSA-N

> <FORMULA>
C16H19NO3

> <MOLECULAR_WEIGHT>
273.332

> <EXACT_MASS>
273.136493476

> <JCHEM_ACCEPTOR_COUNT>
3

> <JCHEM_ATOM_COUNT>
39

> <JCHEM_AVERAGE_POLARIZABILITY>
28.063860531285293

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
14-methyl-11-oxa-5-azapentacyclo[7.4.3.1¹⁰,¹³.0¹,¹⁶.0⁵,¹⁶]heptadec-3-ene-2,12-dione

> <ALOGPS_LOGP>
1.21

> <JCHEM_LOGP>
1.467776324

> <ALOGPS_LOGS>
-1.40

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
5

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_BASIC>
-0.6251814867613993

> <JCHEM_POLAR_SURFACE_AREA>
46.61

> <JCHEM_REFRACTIVITY>
72.47139999999999

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
1.09e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
14-methyl-11-oxa-5-azapentacyclo[7.4.3.1¹⁰,¹³.0¹,¹⁶.0⁵,¹⁶]heptadec-3-ene-2,12-dione

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 23-APR-15   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   23-APR-15         0                                  
HETATM    1  C   UNK     0       1.624  -3.335   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       2.534  -2.093   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       2.265  -0.727   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       3.712  -0.302   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       5.044   0.692   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       4.803   2.236   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       3.383   2.849   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       2.135   1.927   0.000  0.00  0.00           C+0
HETATM    9  N   UNK     0       2.233   0.350   0.000  0.00  0.00           N+0
HETATM   10  C   UNK     0       0.997  -0.809   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       1.275  -2.414   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       2.811  -3.063   0.000  0.00  0.00           C+0
HETATM   13  O   UNK     0       3.080  -4.579   0.000  0.00  0.00           O+0
HETATM   14  C   UNK     0       4.030  -1.924   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       5.630  -2.395   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       6.049  -1.082   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       6.598   0.105   0.000  0.00  0.00           C+0
HETATM   18  O   UNK     0       7.858  -0.949   0.000  0.00  0.00           O+0
HETATM   19  C   UNK     0       7.261  -2.480   0.000  0.00  0.00           C+0
HETATM   20  O   UNK     0       8.097  -3.774   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3   14                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5    9   14                                             
CONECT    5    4    6   17                                                  
CONECT    6    5    7                                                       
CONECT    7    6    8                                                       
CONECT    8    7    9                                                       
CONECT    9    8    4   10                                                  
CONECT   10    9   11                                                       
CONECT   11   10   12                                                       
CONECT   12   11   13   14                                                  
CONECT   13   12                                                            
CONECT   14   12    2    4   15                                             
CONECT   15   14   16   19                                                  
CONECT   16   15   17                                                       
CONECT   17   16    5   18                                                  
CONECT   18   17   19                                                       
CONECT   19   18   15   20                                                  
CONECT   20   19                                                            
MASTER        0    0    0    0    0    0    0    0   20    0   48    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₁₆H₁₉NO₃

Average Mass

273.3320 Da

Monoisotopic Mass

273.13649 Da

IUPAC Name

14-methyl-11-oxa-5-azapentacyclo[7.4.3.1¹⁰,¹³.0¹,¹⁶.0⁵,¹⁶]heptadec-3-ene-2,12-dione

Traditional Name

14-methyl-11-oxa-5-azapentacyclo[7.4.3.1¹⁰,¹³.0¹,¹⁶.0⁵,¹⁶]heptadec-3-ene-2,12-dione

CAS Registry Number

Not Available

SMILES

CC1CC23C4CCCN2C=CC(=O)C13C1CC4OC1=O

InChI Identifier

InChI=1S/C16H19NO3/c1-9-8-15-10-3-2-5-17(15)6-4-13(18)16(9,15)11-7-12(10)20-14(11)19/h4,6,9-12H,2-3,5,7-8H2,1H3

InChI Key

GBFAZBCNZLUZBE-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

Not Available

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as quinolidines. These are organic compounds containing a quinolidine or decahydroquinoline moiety, which is a bicyclic skeleton consisting of a piperidine fused to a cyclohexane ring.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Quinolidines

Sub Class

Not Available

Direct Parent

Quinolidines

Alternative Parents

Substituents

Quinolidine
Caprolactone
Oxepane
Tetrahydropyridine
Gamma butyrolactone
Piperidine
Vinylogous amide
Tetrahydrofuran
Amino acid or derivatives
Carboxylic acid ester
Ketone
Lactone
Tertiary aliphatic amine
Tertiary amine
Carboxylic acid derivative
Enamine
Allylamine
Monocarboxylic acid or derivatives
Oxacycle
Azacycle
Organic nitrogen compound
Organic oxide
Amine
Organopnictogen compound
Hydrocarbon derivative
Organic oxygen compound
Organonitrogen compound
Organooxygen compound
Carbonyl group
Aliphatic heteropolycyclic compound

Molecular Framework

Aliphatic 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	1.21	ALOGPS
logP	1.47	ChemAxon
logS	-1.4	ALOGPS
pKa (Strongest Basic)	-0.63	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	3	ChemAxon
Hydrogen Donor Count	0	ChemAxon
Polar Surface Area	46.61 Å²	ChemAxon
Rotatable Bond Count	0	ChemAxon
Refractivity	72.47 m³·mol⁻¹	ChemAxon
Polarizability	28.06 Å³	ChemAxon
Number of Rings	5	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

Not Available

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

Not Available

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

Not Available

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

LOTUS database [Link]

Showing NP-Card for 14-methyl-11-oxa-5-azapentacyclo[7.4.3.1¹⁰,¹³.0¹,¹⁶.0⁵,¹⁶]heptadec-3-ene-2,12-dione (NP0293839)

MOL for NP0293839 (14-methyl-11-oxa-5-azapentacyclo[7.4.3.1¹⁰,¹³.0¹,¹⁶.0⁵,¹⁶]heptadec-3-ene-2,12-dione)

3D MOL for NP0293839 (14-methyl-11-oxa-5-azapentacyclo[7.4.3.1¹⁰,¹³.0¹,¹⁶.0⁵,¹⁶]heptadec-3-ene-2,12-dione)

3D SDF for NP0293839 (14-methyl-11-oxa-5-azapentacyclo[7.4.3.1¹⁰,¹³.0¹,¹⁶.0⁵,¹⁶]heptadec-3-ene-2,12-dione)

3D-SDF for NP0293839 (14-methyl-11-oxa-5-azapentacyclo[7.4.3.1¹⁰,¹³.0¹,¹⁶.0⁵,¹⁶]heptadec-3-ene-2,12-dione)

PDB for NP0293839 (14-methyl-11-oxa-5-azapentacyclo[7.4.3.1¹⁰,¹³.0¹,¹⁶.0⁵,¹⁶]heptadec-3-ene-2,12-dione)

3D PDB for NP0293839 (14-methyl-11-oxa-5-azapentacyclo[7.4.3.1¹⁰,¹³.0¹,¹⁶.0⁵,¹⁶]heptadec-3-ene-2,12-dione)

SMILES for NP0293839 (14-methyl-11-oxa-5-azapentacyclo[7.4.3.1¹⁰,¹³.0¹,¹⁶.0⁵,¹⁶]heptadec-3-ene-2,12-dione)

INCHI for NP0293839 (14-methyl-11-oxa-5-azapentacyclo[7.4.3.1¹⁰,¹³.0¹,¹⁶.0⁵,¹⁶]heptadec-3-ene-2,12-dione)

Structure for NP0293839 (14-methyl-11-oxa-5-azapentacyclo[7.4.3.1¹⁰,¹³.0¹,¹⁶.0⁵,¹⁶]heptadec-3-ene-2,12-dione)

3D Structure for NP0293839 (14-methyl-11-oxa-5-azapentacyclo[7.4.3.1¹⁰,¹³.0¹,¹⁶.0⁵,¹⁶]heptadec-3-ene-2,12-dione)