NP-MRD: Showing NP-Card for (1e,3e,5s,7r,8r,10r,11r,12s,15r,16s,18z,25s)-11-ethyl-2,20,27-trihydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.0⁵,¹⁶.0⁷,¹⁵.0⁸,¹²]octacosa-1,3,13,18,20,26-hexaen-28-one (NP0186227)

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Record Information

Version

2.0

Created at

2022-09-04 01:59:09 UTC

Updated at

2022-09-04 01:59:09 UTC

NP-MRD ID

NP0186227

Secondary Accession Numbers

None

Natural Product Identification

Common Name

(1e,3e,5s,7r,8r,10r,11r,12s,15r,16s,18z,25s)-11-ethyl-2,20,27-trihydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.0⁵,¹⁶.0⁷,¹⁵.0⁸,¹²]octacosa-1,3,13,18,20,26-hexaen-28-one

Description

Ikarugamycin belongs to the class of organic compounds known as macrolactams. These are cyclic amides of amino carboxylic acids, having a 1-azacycloalkan-2-one structure, or analogues having unsaturation or heteroatoms replacing one or more carbon atoms of the ring. They are nitrogen analogues (the a nitrogen atom replacing the o atom of the cyclic carboxylic acid group ) of the naturally occurring macrolides. (1e,3e,5s,7r,8r,10r,11r,12s,15r,16s,18z,25s)-11-ethyl-2,20,27-trihydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.0⁵,¹⁶.0⁷,¹⁵.0⁸,¹²]octacosa-1,3,13,18,20,26-hexaen-28-one is found in Streptomyces harbinensis, Streptomyces xiamenensis and Streptomyces zhaozhouensis. (1e,3e,5s,7r,8r,10r,11r,12s,15r,16s,18z,25s)-11-ethyl-2,20,27-trihydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.0⁵,¹⁶.0⁷,¹⁵.0⁸,¹²]octacosa-1,3,13,18,20,26-hexaen-28-one was first documented in 2022 (PMID: 35063731). Based on a literature review a small amount of articles have been published on Ikarugamycin (PMID: 35629283) (PMID: 35572732) (PMID: 35086337) (PMID: 35082520).

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1652309042203592D          

 35 39  0  0  1  0            999 V2000
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M  END

     RDKit          3D

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M  END


  Mrv1652309042203592D          

 35 39  0  0  1  0            999 V2000
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   11.7239   -0.0691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7124   -1.0122    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4351   -1.4102    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3  2  1  1  0  0  0
  3  4  1  0  0  0  0
  4  5  1  6  0  0  0
  5  6  2  0  0  0  0
  7  6  1  6  0  0  0
  7  8  1  0  0  0  0
  8  9  1  1  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  1  0  0  0  0
 12 14  2  0  0  0  0
 14 15  1  4  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
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 20 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
  8 27  1  0  0  0  0
 27 28  1  6  0  0  0
 29 28  1  6  0  0  0
  7 29  1  0  0  0  0
 29 30  1  0  0  0  0
  4 30  1  0  0  0  0
 30 31  1  1  0  0  0
 31 32  1  0  0  0  0
  3 32  1  0  0  0  0
 32 33  1  1  0  0  0
 22 34  1  0  0  0  0
 18 34  1  0  0  0  0
 34 35  2  0  0  0  0
M  END
> <DATABASE_ID>
NP0186227

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CC[C@@H]1[C@H](C)C[C@@H]2[C@H]3C[C@H]4\C=C\C(\O)=C5\C(O)=N[C@@H](CCCN=C(O)\C=C/C[C@@H]4[C@H]3C=C[C@@H]12)C5=O

> <INCHI_IDENTIFIER>
InChI=1S/C29H38N2O4/c1-3-18-16(2)14-22-20(18)10-11-21-19-6-4-8-26(33)30-13-5-7-24-28(34)27(29(35)31-24)25(32)12-9-17(19)15-23(21)22/h4,8-12,16-24,32H,3,5-7,13-15H2,1-2H3,(H,30,33)(H,31,35)/b8-4-,12-9+,27-25-/t16-,17-,18-,19+,20+,21-,22+,23+,24+/m1/s1

> <INCHI_KEY>
GHXZHWYUSAWISC-KZRBWAKNSA-N

> <FORMULA>
C29H38N2O4

> <MOLECULAR_WEIGHT>
478.633

> <EXACT_MASS>
478.283157712

> <JCHEM_ACCEPTOR_COUNT>
6

> <JCHEM_ATOM_COUNT>
73

> <JCHEM_AVERAGE_POLARIZABILITY>
52.97003344174402

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
3

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(3E,5S,7R,8R,10R,11R,12S,15R,16S,18Z,25S)-11-ethyl-2,20,27-trihydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.0^{5,16}.0^{7,15}.0^{8,12}]octacosa-1,3,13,18,20,26-hexaen-28-one

> <JCHEM_LOGP>
3.4148577989428146

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
5

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA>
4.962974228634341

> <JCHEM_PKA_STRONGEST_ACIDIC>
3.9248900734428998

> <JCHEM_PKA_STRONGEST_BASIC>
6.7889999622840955

> <JCHEM_POLAR_SURFACE_AREA>
102.48000000000002

> <JCHEM_REFRACTIVITY>
140.87709999999998

> <JCHEM_ROTATABLE_BOND_COUNT>
1

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
(3E,5S,7R,8R,10R,11R,12S,15R,16S,18Z,25S)-11-ethyl-2,20,27-trihydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.0^{5,16}.0^{7,15}.0^{8,12}]octacosa-1,3,13,18,20,26-hexaen-28-one

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 04-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   04-SEP-22         0                                  
HETATM    1  C   UNK     0      22.754  -3.069   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      21.254  -3.420   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      20.201  -2.296   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      18.673  -2.488   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      17.793  -3.752   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      16.259  -3.622   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      15.755  -2.071   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      14.130  -1.782   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      15.479  -2.525   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      15.510  -4.064   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      14.192  -4.861   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      12.843  -4.118   0.000  0.00  0.00           C+0
HETATM   13  O   UNK     0      12.812  -2.579   0.000  0.00  0.00           O+0
HETATM   14  N   UNK     0      11.526  -4.915   0.000  0.00  0.00           N+0
HETATM   15  C   UNK     0      10.177  -4.172   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       8.859  -4.969   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       7.510  -4.226   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       7.479  -2.686   0.000  0.00  0.00           C+0
HETATM   19  N   UNK     0       6.425  -1.563   0.000  0.00  0.00           N+0
HETATM   20  C   UNK     0       7.168  -0.214   0.000  0.00  0.00           C+0
HETATM   21  O   UNK     0       6.442   1.144   0.000  0.00  0.00           O+0
HETATM   22  C   UNK     0       8.765  -0.350   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      10.083   0.447   0.000  0.00  0.00           C+0
HETATM   24  O   UNK     0      10.052   1.987   0.000  0.00  0.00           O+0
HETATM   25  C   UNK     0      11.432  -0.296   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0      12.750   0.501   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0      14.099  -0.242   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0      15.554   0.263   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0      16.484  -0.964   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0      18.018  -1.094   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0      19.142  -0.041   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0      20.491  -0.784   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0      21.885  -0.129   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0       8.796  -1.890   0.000  0.00  0.00           C+0
HETATM   35  O   UNK     0      10.145  -2.632   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3                                                       
CONECT    3    2    4   32                                                  
CONECT    4    3    5   30                                                  
CONECT    5    4    6                                                       
CONECT    6    5    7                                                       
CONECT    7    6    8   29                                                  
CONECT    8    7    9   27                                                  
CONECT    9    8   10                                                       
CONECT   10    9   11                                                       
CONECT   11   10   12                                                       
CONECT   12   11   13   14                                                  
CONECT   13   12                                                            
CONECT   14   12   15                                                       
CONECT   15   14   16                                                       
CONECT   16   15   17                                                       
CONECT   17   16   18                                                       
CONECT   18   17   19   34                                                  
CONECT   19   18   20                                                       
CONECT   20   19   21   22                                                  
CONECT   21   20                                                            
CONECT   22   20   23   34                                                  
CONECT   23   22   24   25                                                  
CONECT   24   23                                                            
CONECT   25   23   26                                                       
CONECT   26   25   27                                                       
CONECT   27   26    8   28                                                  
CONECT   28   27   29                                                       
CONECT   29   28    7   30                                                  
CONECT   30   29    4   31                                                  
CONECT   31   30   32                                                       
CONECT   32   31    3   33                                                  
CONECT   33   32                                                            
CONECT   34   22   18   35                                                  
CONECT   35   34                                                            
MASTER        0    0    0    0    0    0    0    0   35    0   78    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₂₉H₃₈N₂O₄

Average Mass

478.6330 Da

Monoisotopic Mass

478.28316 Da

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

CC[C@@H]1[C@H](C)C[C@@H]2[C@H]3C[C@H]4\C=C\C(\O)=C5\C(O)=N[C@@H](CCCN=C(O)\C=C/C[C@@H]4[C@H]3C=C[C@@H]12)C5=O

InChI Identifier

InChI=1S/C29H38N2O4/c1-3-18-16(2)14-22-20(18)10-11-21-19-6-4-8-26(33)30-13-5-7-24-28(34)27(29(35)31-24)25(32)12-9-17(19)15-23(21)22/h4,8-12,16-24,32H,3,5-7,13-15H2,1-2H3,(H,30,33)(H,31,35)/b8-4-,12-9+,27-25-/t16-,17-,18-,19+,20+,21-,22+,23+,24+/m1/s1

InChI Key

GHXZHWYUSAWISC-KZRBWAKNSA-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
Streptomyces harbinensis	LOTUS Database	35616633
Streptomyces xiamenensis	LOTUS Database	35616633
Streptomyces zhaozhouensis	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as macrolactams. These are cyclic amides of amino carboxylic acids, having a 1-azacycloalkan-2-one structure, or analogues having unsaturation or heteroatoms replacing one or more carbon atoms of the ring. They are nitrogen analogues (the a nitrogen atom replacing the o atom of the cyclic carboxylic acid group ) of the naturally occurring macrolides.

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Macrolactams

Sub Class

Not Available

Direct Parent

Macrolactams

Alternative Parents

Substituents

Macrolactam
11-noriridane monoterpenoid
Monoterpenoid
Pyrrolidone
2-pyrrolidone
3-pyrrolidone
Pyrrolidine
Vinylogous acid
Carboxamide group
Ketone
Lactam
Secondary carboxylic acid amide
Enol
Azacycle
Organoheterocyclic compound
Carboxylic acid derivative
Organooxygen compound
Organonitrogen compound
Organic oxide
Organic oxygen compound
Carbonyl group
Organic nitrogen compound
Hydrocarbon derivative
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

External Links

HMDB ID

Not Available

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

Not Available

KNApSAcK ID

C00014916

Chemspider ID

78432978

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

54680304

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Li K, Chen S, Pang X, Cai J, Zhang X, Liu Y, Zhu Y, Zhou X: Natural products from mangrove sediments-derived microbes: Structural diversity, bioactivities, biosynthesis, and total synthesis. Eur J Med Chem. 2022 Feb 15;230:114117. doi: 10.1016/j.ejmech.2022.114117. Epub 2022 Jan 12. [PubMed:35063731 ]
Morita A, Sakauchi K, Taira W, Otaki JM: Ingestional Toxicity of Radiation-Dependent Metabolites of the Host Plant for the Pale Grass Blue Butterfly: A Mechanism of Field Effects of Radioactive Pollution in Fukushima. Life (Basel). 2022 Apr 20;12(5):615. doi: 10.3390/life12050615. [PubMed:35629283 ]
Wang X, Zhu X, Peng L, Zhao Y: Identification of lncRNA Biomarkers and LINC01198 Promotes Progression of Chronic Rhinosinusitis with Nasal Polyps through Sponge miR-6776-5p. Biomed Res Int. 2022 May 6;2022:9469207. doi: 10.1155/2022/9469207. eCollection 2022. [PubMed:35572732 ]
Yang J, Qi Y, Blodgett JAV, Wencewicz TA: Multifunctional P450 Monooxygenase CftA Diversifies the Clifednamide Pool through Tandem C-H Bond Activations. J Nat Prod. 2022 Jan 28;85(1):47-55. doi: 10.1021/acs.jnatprod.1c00606. Epub 2022 Jan 4. [PubMed:35086337 ]
Yu N, Liu X, Shi D, Bai L, Niu T, Liu Y: CD63 and C3AR1: The Potential Molecular Targets in the Progression of Septic Shock. Int J Gen Med. 2022 Jan 19;15:711-728. doi: 10.2147/IJGM.S338486. eCollection 2022. [PubMed:35082520 ]
LOTUS database [Link]

Showing NP-Card for (1e,3e,5s,7r,8r,10r,11r,12s,15r,16s,18z,25s)-11-ethyl-2,20,27-trihydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.0⁵,¹⁶.0⁷,¹⁵.0⁸,¹²]octacosa-1,3,13,18,20,26-hexaen-28-one (NP0186227)

MOL for NP0186227 ((1e,3e,5s,7r,8r,10r,11r,12s,15r,16s,18z,25s)-11-ethyl-2,20,27-trihydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.0⁵,¹⁶.0⁷,¹⁵.0⁸,¹²]octacosa-1,3,13,18,20,26-hexaen-28-one)

3D MOL for NP0186227 ((1e,3e,5s,7r,8r,10r,11r,12s,15r,16s,18z,25s)-11-ethyl-2,20,27-trihydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.0⁵,¹⁶.0⁷,¹⁵.0⁸,¹²]octacosa-1,3,13,18,20,26-hexaen-28-one)

3D SDF for NP0186227 ((1e,3e,5s,7r,8r,10r,11r,12s,15r,16s,18z,25s)-11-ethyl-2,20,27-trihydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.0⁵,¹⁶.0⁷,¹⁵.0⁸,¹²]octacosa-1,3,13,18,20,26-hexaen-28-one)

3D-SDF for NP0186227 ((1e,3e,5s,7r,8r,10r,11r,12s,15r,16s,18z,25s)-11-ethyl-2,20,27-trihydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.0⁵,¹⁶.0⁷,¹⁵.0⁸,¹²]octacosa-1,3,13,18,20,26-hexaen-28-one)

PDB for NP0186227 ((1e,3e,5s,7r,8r,10r,11r,12s,15r,16s,18z,25s)-11-ethyl-2,20,27-trihydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.0⁵,¹⁶.0⁷,¹⁵.0⁸,¹²]octacosa-1,3,13,18,20,26-hexaen-28-one)

3D PDB for NP0186227 ((1e,3e,5s,7r,8r,10r,11r,12s,15r,16s,18z,25s)-11-ethyl-2,20,27-trihydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.0⁵,¹⁶.0⁷,¹⁵.0⁸,¹²]octacosa-1,3,13,18,20,26-hexaen-28-one)

SMILES for NP0186227 ((1e,3e,5s,7r,8r,10r,11r,12s,15r,16s,18z,25s)-11-ethyl-2,20,27-trihydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.0⁵,¹⁶.0⁷,¹⁵.0⁸,¹²]octacosa-1,3,13,18,20,26-hexaen-28-one)

INCHI for NP0186227 ((1e,3e,5s,7r,8r,10r,11r,12s,15r,16s,18z,25s)-11-ethyl-2,20,27-trihydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.0⁵,¹⁶.0⁷,¹⁵.0⁸,¹²]octacosa-1,3,13,18,20,26-hexaen-28-one)

Structure for NP0186227 ((1e,3e,5s,7r,8r,10r,11r,12s,15r,16s,18z,25s)-11-ethyl-2,20,27-trihydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.0⁵,¹⁶.0⁷,¹⁵.0⁸,¹²]octacosa-1,3,13,18,20,26-hexaen-28-one)

3D Structure for NP0186227 ((1e,3e,5s,7r,8r,10r,11r,12s,15r,16s,18z,25s)-11-ethyl-2,20,27-trihydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.0⁵,¹⁶.0⁷,¹⁵.0⁸,¹²]octacosa-1,3,13,18,20,26-hexaen-28-one)