NP-MRD: Showing NP-Card for 7-(1,2-dihydroxy-7-phenylhepta-4,6-dien-1-yl)-2,5,6,9,11,14,17,20,24a-nonahydroxy-18-(1h-indol-3-ylmethyl)-3-methoxy-22-methyl-3h,3ah,6h,7h,10h,11h,12h,15h,18h,21h,24h-pyrrolo[2,3-m]1,4,7,10,15,19-hexaazacyclotricosan-23-one (NP0320070)

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Record Information

Version

2.0

Created at

2022-09-11 21:28:27 UTC

Updated at

2022-09-11 21:28:27 UTC

NP-MRD ID

NP0320070

Secondary Accession Numbers

None

Natural Product Identification

Common Name

7-(1,2-dihydroxy-7-phenylhepta-4,6-dien-1-yl)-2,5,6,9,11,14,17,20,24a-nonahydroxy-18-(1h-indol-3-ylmethyl)-3-methoxy-22-methyl-3h,3ah,6h,7h,10h,11h,12h,15h,18h,21h,24h-pyrrolo[2,3-m]1,4,7,10,15,19-hexaazacyclotricosan-23-one

Description

7-(1,2-Dihydroxy-7-phenylhepta-4,6-dien-1-yl)-2,5,6,9,11,14,17,20,24a-nonahydroxy-18-[(1H-indol-3-yl)methyl]-3-methoxy-22-methyl-3H,3aH,6H,7H,10H,11H,12H,15H,18H,21H,22H,23H,24H,24aH-pyrrolo[2,3-m]1,4,7,10,15,19-hexaazacyclotricosan-23-one belongs to the class of organic compounds known as cyclic peptides. Cyclic peptides are compounds containing a cyclic moiety bearing a peptide backbone. 7-(1,2-dihydroxy-7-phenylhepta-4,6-dien-1-yl)-2,5,6,9,11,14,17,20,24a-nonahydroxy-18-(1h-indol-3-ylmethyl)-3-methoxy-22-methyl-3h,3ah,6h,7h,10h,11h,12h,15h,18h,21h,24h-pyrrolo[2,3-m]1,4,7,10,15,19-hexaazacyclotricosan-23-one is found in Chondromyces pediculatus. Based on a literature review very few articles have been published on 7-(1,2-dihydroxy-7-phenylhepta-4,6-dien-1-yl)-2,5,6,9,11,14,17,20,24a-nonahydroxy-18-[(1H-indol-3-yl)methyl]-3-methoxy-22-methyl-3H,3aH,6H,7H,10H,11H,12H,15H,18H,21H,22H,23H,24H,24aH-pyrrolo[2,3-m]1,4,7,10,15,19-hexaazacyclotricosan-23-one.

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1652309112223282D          

 64 68  0  0  0  0            999 V2000
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M  END

     RDKit          3D

118122  0  0  0  0  0  0  0  0999 V2000
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M  END


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M  END
> <DATABASE_ID>
NP0320070

> <DATABASE_NAME>
NP-MRD

> <SMILES>
COC1C2N=C(O)C(O)C(N=C(O)CC(O)CN=C(O)CN=C(O)C(CC3=CNC4=CC=CC=C34)N=C(O)CN(C)C(=O)CC2(O)N=C1O)C(O)C(O)CC=CC=CC1=CC=CC=C1

> <INCHI_IDENTIFIER>
InChI=1S/C43H54N8O13/c1-51-23-33(56)47-29(17-25-20-44-28-15-10-9-14-27(25)28)40(60)46-22-32(55)45-21-26(52)18-31(54)48-35(36(58)30(53)16-8-4-7-13-24-11-5-3-6-12-24)37(59)41(61)49-39-38(64-2)42(62)50-43(39,63)19-34(51)57/h3-15,20,26,29-30,35-39,44,52-53,58-59,63H,16-19,21-23H2,1-2H3,(H,45,55)(H,46,60)(H,47,56)(H,48,54)(H,49,61)(H,50,62)

> <INCHI_KEY>
NPRMKCREBUKCFL-UHFFFAOYSA-N

> <FORMULA>
C43H54N8O13

> <MOLECULAR_WEIGHT>
890.948

> <EXACT_MASS>
890.381033831

> <JCHEM_ACCEPTOR_COUNT>
19

> <JCHEM_ATOM_COUNT>
118

> <JCHEM_AVERAGE_POLARIZABILITY>
89.47547691655707

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
12

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
7-(1,2-dihydroxy-7-phenylhepta-4,6-dien-1-yl)-2,5,6,9,11,14,17,20,24a-nonahydroxy-18-[(1H-indol-3-yl)methyl]-3-methoxy-22-methyl-3H,3aH,6H,7H,10H,11H,12H,15H,18H,21H,22H,23H,24H,24aH-pyrrolo[2,3-m]1,4,7,10,15,19-hexaazacyclotricosan-23-one

> <JCHEM_LOGP>
-0.31846403797964856

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
5

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
2.729430245436

> <JCHEM_PKA_STRONGEST_ACIDIC>
2.1373890955846346

> <JCHEM_PKA_STRONGEST_BASIC>
4.400130609911488

> <JCHEM_POLAR_SURFACE_AREA>
342.02000000000004

> <JCHEM_REFRACTIVITY>
230.47720000000004

> <JCHEM_ROTATABLE_BOND_COUNT>
9

> <JCHEM_RULE_OF_FIVE>
0

> <JCHEM_TRADITIONAL_IUPAC>
7-(1,2-dihydroxy-7-phenylhepta-4,6-dien-1-yl)-2,5,6,9,11,14,17,20,24a-nonahydroxy-18-(1H-indol-3-ylmethyl)-3-methoxy-22-methyl-3H,3aH,6H,7H,10H,11H,12H,15H,18H,21H,24H-pyrrolo[2,3-m]1,4,7,10,15,19-hexaazacyclotricosan-23-one

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 11-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   11-SEP-22         0                                  
HETATM    1  C   UNK     0       0.819  -7.415   0.000  0.00  0.00           C+0
HETATM    2  O   UNK     0       1.990  -6.415   0.000  0.00  0.00           O+0
HETATM    3  C   UNK     0       1.709  -4.901   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       0.319  -4.238   0.000  0.00  0.00           C+0
HETATM    5  O   UNK     0      -1.034  -4.973   0.000  0.00  0.00           O+0
HETATM    6  N   UNK     0       0.520  -2.711   0.000  0.00  0.00           N+0
HETATM    7  C   UNK     0       2.035  -2.430   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0       1.135  -1.181   0.000  0.00  0.00           O+0
HETATM    9  C   UNK     0       2.852  -0.957   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       2.571   0.558   0.000  0.00  0.00           C+0
HETATM   11  O   UNK     0       1.181   1.220   0.000  0.00  0.00           O+0
HETATM   12  N   UNK     0       3.924   1.292   0.000  0.00  0.00           N+0
HETATM   13  C   UNK     0       4.125   2.819   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       5.041   0.232   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       6.723   0.115   0.000  0.00  0.00           C+0
HETATM   16  O   UNK     0       7.556   1.411   0.000  0.00  0.00           O+0
HETATM   17  N   UNK     0       7.458  -1.238   0.000  0.00  0.00           N+0
HETATM   18  C   UNK     0       8.997  -1.278   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       9.802   0.035   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      11.341  -0.005   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      12.213  -1.274   0.000  0.00  0.00           C+0
HETATM   22  N   UNK     0      13.690  -0.837   0.000  0.00  0.00           N+0
HETATM   23  C   UNK     0      13.730   0.702   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      14.901   1.703   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      14.620   3.217   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0      13.169   3.731   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0      11.998   2.731   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0      12.278   1.216   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0       9.732  -2.632   0.000  0.00  0.00           C+0
HETATM   30  O   UNK     0       8.927  -3.945   0.000  0.00  0.00           O+0
HETATM   31  N   UNK     0      11.271  -2.672   0.000  0.00  0.00           N+0
HETATM   32  C   UNK     0      12.006  -4.025   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0      13.546  -4.065   0.000  0.00  0.00           C+0
HETATM   34  O   UNK     0      14.350  -2.752   0.000  0.00  0.00           O+0
HETATM   35  N   UNK     0      14.281  -5.419   0.000  0.00  0.00           N+0
HETATM   36  C   UNK     0      13.476  -6.732   0.000  0.00  0.00           C+0
HETATM   37  C   UNK     0      11.937  -6.692   0.000  0.00  0.00           C+0
HETATM   38  O   UNK     0      11.202  -5.338   0.000  0.00  0.00           O+0
HETATM   39  C   UNK     0      11.132  -8.005   0.000  0.00  0.00           C+0
HETATM   40  C   UNK     0       9.593  -7.964   0.000  0.00  0.00           C+0
HETATM   41  O   UNK     0       8.788  -9.278   0.000  0.00  0.00           O+0
HETATM   42  N   UNK     0       8.858  -6.611   0.000  0.00  0.00           N+0
HETATM   43  C   UNK     0       7.318  -6.571   0.000  0.00  0.00           C+0
HETATM   44  C   UNK     0       6.514  -7.884   0.000  0.00  0.00           C+0
HETATM   45  O   UNK     0       4.974  -7.844   0.000  0.00  0.00           O+0
HETATM   46  C   UNK     0       7.248  -9.237   0.000  0.00  0.00           C+0
HETATM   47  O   UNK     0       8.470 -10.175   0.000  0.00  0.00           O+0
HETATM   48  C   UNK     0       6.444 -10.550   0.000  0.00  0.00           C+0
HETATM   49  C   UNK     0       7.179 -11.904   0.000  0.00  0.00           C+0
HETATM   50  C   UNK     0       8.718 -11.944   0.000  0.00  0.00           C+0
HETATM   51  C   UNK     0       9.453 -13.297   0.000  0.00  0.00           C+0
HETATM   52  C   UNK     0      10.993 -13.338   0.000  0.00  0.00           C+0
HETATM   53  C   UNK     0      11.728 -14.691   0.000  0.00  0.00           C+0
HETATM   54  C   UNK     0      13.267 -14.731   0.000  0.00  0.00           C+0
HETATM   55  C   UNK     0      14.002 -16.084   0.000  0.00  0.00           C+0
HETATM   56  C   UNK     0      13.197 -17.398   0.000  0.00  0.00           C+0
HETATM   57  C   UNK     0      11.658 -17.357   0.000  0.00  0.00           C+0
HETATM   58  C   UNK     0      10.923 -16.004   0.000  0.00  0.00           C+0
HETATM   59  C   UNK     0       6.583  -5.218   0.000  0.00  0.00           C+0
HETATM   60  O   UNK     0       7.388  -3.904   0.000  0.00  0.00           O+0
HETATM   61  C   UNK     0       5.044  -5.177   0.000  0.00  0.00           C+0
HETATM   62  O   UNK     0       4.239  -6.490   0.000  0.00  0.00           O+0
HETATM   63  N   UNK     0       4.309  -3.824   0.000  0.00  0.00           N+0
HETATM   64  C   UNK     0       2.769  -3.784   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3                                                       
CONECT    3    2    4   64                                                  
CONECT    4    3    5    6                                                  
CONECT    5    4                                                            
CONECT    6    4    7                                                       
CONECT    7    6    8    9   64                                             
CONECT    8    7                                                            
CONECT    9    7   10                                                       
CONECT   10    9   11   12                                                  
CONECT   11   10                                                            
CONECT   12   10   13   14                                                  
CONECT   13   12                                                            
CONECT   14   12   15                                                       
CONECT   15   14   16   17                                                  
CONECT   16   15                                                            
CONECT   17   15   18                                                       
CONECT   18   17   19   29                                                  
CONECT   19   18   20                                                       
CONECT   20   19   21   28                                                  
CONECT   21   20   22                                                       
CONECT   22   21   23                                                       
CONECT   23   22   24   28                                                  
CONECT   24   23   25                                                       
CONECT   25   24   26                                                       
CONECT   26   25   27                                                       
CONECT   27   26   28                                                       
CONECT   28   27   20   23                                                  
CONECT   29   18   30   31                                                  
CONECT   30   29                                                            
CONECT   31   29   32                                                       
CONECT   32   31   33                                                       
CONECT   33   32   34   35                                                  
CONECT   34   33                                                            
CONECT   35   33   36                                                       
CONECT   36   35   37                                                       
CONECT   37   36   38   39                                                  
CONECT   38   37                                                            
CONECT   39   37   40                                                       
CONECT   40   39   41   42                                                  
CONECT   41   40                                                            
CONECT   42   40   43                                                       
CONECT   43   42   44   59                                                  
CONECT   44   43   45   46                                                  
CONECT   45   44                                                            
CONECT   46   44   47   48                                                  
CONECT   47   46                                                            
CONECT   48   46   49                                                       
CONECT   49   48   50                                                       
CONECT   50   49   51                                                       
CONECT   51   50   52                                                       
CONECT   52   51   53                                                       
CONECT   53   52   54   58                                                  
CONECT   54   53   55                                                       
CONECT   55   54   56                                                       
CONECT   56   55   57                                                       
CONECT   57   56   58                                                       
CONECT   58   57   53                                                       
CONECT   59   43   60   61                                                  
CONECT   60   59                                                            
CONECT   61   59   62   63                                                  
CONECT   62   61                                                            
CONECT   63   61   64                                                       
CONECT   64   63    3    7                                                  
MASTER        0    0    0    0    0    0    0    0   64    0  136    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₄₃H₅₄N₈O₁₃

Average Mass

890.9480 Da

Monoisotopic Mass

890.38103 Da

IUPAC Name

7-(1,2-dihydroxy-7-phenylhepta-4,6-dien-1-yl)-2,5,6,9,11,14,17,20,24a-nonahydroxy-18-[(1H-indol-3-yl)methyl]-3-methoxy-22-methyl-3H,3aH,6H,7H,10H,11H,12H,15H,18H,21H,22H,23H,24H,24aH-pyrrolo[2,3-m]1,4,7,10,15,19-hexaazacyclotricosan-23-one

Traditional Name

7-(1,2-dihydroxy-7-phenylhepta-4,6-dien-1-yl)-2,5,6,9,11,14,17,20,24a-nonahydroxy-18-(1H-indol-3-ylmethyl)-3-methoxy-22-methyl-3H,3aH,6H,7H,10H,11H,12H,15H,18H,21H,24H-pyrrolo[2,3-m]1,4,7,10,15,19-hexaazacyclotricosan-23-one

CAS Registry Number

Not Available

SMILES

COC1C2N=C(O)C(O)C(N=C(O)CC(O)CN=C(O)CN=C(O)C(CC3=CNC4=CC=CC=C34)N=C(O)CN(C)C(=O)CC2(O)N=C1O)C(O)C(O)CC=CC=CC1=CC=CC=C1

InChI Identifier

InChI=1S/C43H54N8O13/c1-51-23-33(56)47-29(17-25-20-44-28-15-10-9-14-27(25)28)40(60)46-22-32(55)45-21-26(52)18-31(54)48-35(36(58)30(53)16-8-4-7-13-24-11-5-3-6-12-24)37(59)41(61)49-39-38(64-2)42(62)50-43(39,63)19-34(51)57/h3-15,20,26,29-30,35-39,44,52-53,58-59,63H,16-19,21-23H2,1-2H3,(H,45,55)(H,46,60)(H,47,56)(H,48,54)(H,49,61)(H,50,62)

InChI Key

NPRMKCREBUKCFL-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

Species Name	Source	Reference
Chondromyces pediculatus	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as cyclic peptides. Cyclic peptides are compounds containing a cyclic moiety bearing a peptide backbone.

Kingdom

Organic compounds

Super Class

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Sub Class

Amino acids, peptides, and analogues

Direct Parent

Cyclic peptides

Alternative Parents

Substituents

Cyclic alpha peptide
Macrolactam
3-alkylindole
Indole
Indole or derivatives
Styrene
Monocyclic benzene moiety
Substituted pyrrole
Benzenoid
Pyrroline
Heteroaromatic compound
Tertiary carboxylic acid amide
Pyrrole
Cyclic carboximidic acid
Lactam
Secondary alcohol
Carboxamide group
Alkanolamine
Dialkyl ether
Ether
Azacycle
Organoheterocyclic compound
Organic 1,3-dipolar compound
Polyol
Propargyl-type 1,3-dipolar organic compound
Hydrocarbon derivative
Organic nitrogen compound
Carbonyl group
Organic oxygen compound
Organonitrogen compound
Organooxygen compound
Organic oxide
Alcohol
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	-0.32	ChemAxon
pKa (Strongest Acidic)	2.14	ChemAxon
pKa (Strongest Basic)	4.4	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	19	ChemAxon
Hydrogen Donor Count	12	ChemAxon
Polar Surface Area	342.02 Å²	ChemAxon
Rotatable Bond Count	9	ChemAxon
Refractivity	230.48 m³·mol⁻¹	ChemAxon
Polarizability	89.48 Å³	ChemAxon
Number of Rings	5	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	Yes	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

163062727

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

LOTUS database [Link]

Showing NP-Card for 7-(1,2-dihydroxy-7-phenylhepta-4,6-dien-1-yl)-2,5,6,9,11,14,17,20,24a-nonahydroxy-18-(1h-indol-3-ylmethyl)-3-methoxy-22-methyl-3h,3ah,6h,7h,10h,11h,12h,15h,18h,21h,24h-pyrrolo[2,3-m]1,4,7,10,15,19-hexaazacyclotricosan-23-one (NP0320070)

MOL for NP0320070 (7-(1,2-dihydroxy-7-phenylhepta-4,6-dien-1-yl)-2,5,6,9,11,14,17,20,24a-nonahydroxy-18-(1h-indol-3-ylmethyl)-3-methoxy-22-methyl-3h,3ah,6h,7h,10h,11h,12h,15h,18h,21h,24h-pyrrolo[2,3-m]1,4,7,10,15,19-hexaazacyclotricosan-23-one)

3D MOL for NP0320070 (7-(1,2-dihydroxy-7-phenylhepta-4,6-dien-1-yl)-2,5,6,9,11,14,17,20,24a-nonahydroxy-18-(1h-indol-3-ylmethyl)-3-methoxy-22-methyl-3h,3ah,6h,7h,10h,11h,12h,15h,18h,21h,24h-pyrrolo[2,3-m]1,4,7,10,15,19-hexaazacyclotricosan-23-one)

3D SDF for NP0320070 (7-(1,2-dihydroxy-7-phenylhepta-4,6-dien-1-yl)-2,5,6,9,11,14,17,20,24a-nonahydroxy-18-(1h-indol-3-ylmethyl)-3-methoxy-22-methyl-3h,3ah,6h,7h,10h,11h,12h,15h,18h,21h,24h-pyrrolo[2,3-m]1,4,7,10,15,19-hexaazacyclotricosan-23-one)

3D-SDF for NP0320070 (7-(1,2-dihydroxy-7-phenylhepta-4,6-dien-1-yl)-2,5,6,9,11,14,17,20,24a-nonahydroxy-18-(1h-indol-3-ylmethyl)-3-methoxy-22-methyl-3h,3ah,6h,7h,10h,11h,12h,15h,18h,21h,24h-pyrrolo[2,3-m]1,4,7,10,15,19-hexaazacyclotricosan-23-one)

PDB for NP0320070 (7-(1,2-dihydroxy-7-phenylhepta-4,6-dien-1-yl)-2,5,6,9,11,14,17,20,24a-nonahydroxy-18-(1h-indol-3-ylmethyl)-3-methoxy-22-methyl-3h,3ah,6h,7h,10h,11h,12h,15h,18h,21h,24h-pyrrolo[2,3-m]1,4,7,10,15,19-hexaazacyclotricosan-23-one)

3D PDB for NP0320070 (7-(1,2-dihydroxy-7-phenylhepta-4,6-dien-1-yl)-2,5,6,9,11,14,17,20,24a-nonahydroxy-18-(1h-indol-3-ylmethyl)-3-methoxy-22-methyl-3h,3ah,6h,7h,10h,11h,12h,15h,18h,21h,24h-pyrrolo[2,3-m]1,4,7,10,15,19-hexaazacyclotricosan-23-one)

SMILES for NP0320070 (7-(1,2-dihydroxy-7-phenylhepta-4,6-dien-1-yl)-2,5,6,9,11,14,17,20,24a-nonahydroxy-18-(1h-indol-3-ylmethyl)-3-methoxy-22-methyl-3h,3ah,6h,7h,10h,11h,12h,15h,18h,21h,24h-pyrrolo[2,3-m]1,4,7,10,15,19-hexaazacyclotricosan-23-one)

INCHI for NP0320070 (7-(1,2-dihydroxy-7-phenylhepta-4,6-dien-1-yl)-2,5,6,9,11,14,17,20,24a-nonahydroxy-18-(1h-indol-3-ylmethyl)-3-methoxy-22-methyl-3h,3ah,6h,7h,10h,11h,12h,15h,18h,21h,24h-pyrrolo[2,3-m]1,4,7,10,15,19-hexaazacyclotricosan-23-one)

Structure for NP0320070 (7-(1,2-dihydroxy-7-phenylhepta-4,6-dien-1-yl)-2,5,6,9,11,14,17,20,24a-nonahydroxy-18-(1h-indol-3-ylmethyl)-3-methoxy-22-methyl-3h,3ah,6h,7h,10h,11h,12h,15h,18h,21h,24h-pyrrolo[2,3-m]1,4,7,10,15,19-hexaazacyclotricosan-23-one)

3D Structure for NP0320070 (7-(1,2-dihydroxy-7-phenylhepta-4,6-dien-1-yl)-2,5,6,9,11,14,17,20,24a-nonahydroxy-18-(1h-indol-3-ylmethyl)-3-methoxy-22-methyl-3h,3ah,6h,7h,10h,11h,12h,15h,18h,21h,24h-pyrrolo[2,3-m]1,4,7,10,15,19-hexaazacyclotricosan-23-one)