NP-MRD: Showing NP-Card for 2-{3,3'-dimethyl-[2,2'-bioxiran]-3-yl}-10-[3-(dimethylamino)-4-hydroxy-3,5-dimethyloxan-2-yl]-11-hydroxy-5-methyl-1-oxatetraphene-4,7,12-trione (NP0275915)

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Record Information

Version

2.0

Created at

2022-09-08 23:49:24 UTC

Updated at

2022-09-08 23:49:24 UTC

NP-MRD ID

NP0275915

Secondary Accession Numbers

None

Natural Product Identification

Common Name

2-{3,3'-dimethyl-[2,2'-bioxiran]-3-yl}-10-[3-(dimethylamino)-4-hydroxy-3,5-dimethyloxan-2-yl]-11-hydroxy-5-methyl-1-oxatetraphene-4,7,12-trione

Description

10-[3-(Dimethylamino)-4-hydroxy-3,5-dimethyloxan-2-yl]-11-hydroxy-5-methyl-2-[2-methyl-3-(3-methyloxiran-2-yl)oxiran-2-yl]naphtho[2,3-h]chromene-4,7,12-trione, also known as ankinomycin, belongs to the class of organic compounds known as anthraquinones. These are organic compounds containing either anthracene-9,10-quinone, 1,4-anthraquinone, or 1,2-anthraquinone. Based on a literature review very few articles have been published on 10-[3-(dimethylamino)-4-hydroxy-3,5-dimethyloxan-2-yl]-11-hydroxy-5-methyl-2-[2-methyl-3-(3-methyloxiran-2-yl)oxiran-2-yl]naphtho[2,3-h]chromene-4,7,12-trione.

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1652309092201492D          

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M  END

     RDKit          3D

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M  END


  Mrv1652309092201492D          

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    1.5246    0.5684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2546   -0.2111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4444   -0.3671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0957    0.2566    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1744    1.0361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3657    1.6598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1758    1.5039    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7159    2.1275    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4459    2.9071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9860    3.5307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6358    3.0630    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3657    3.8425    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0957    2.4393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6928    2.1967    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5464    2.9573    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3161    2.6602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4189    3.7724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9845    1.1921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2546    1.9716    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7946   -0.8348    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5246   -1.6143    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  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  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
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
  9 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 13 15  1  0  0  0  0
 15 16  1  0  0  0  0
  8 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
  2 20  2  0  0  0  0
  6 20  1  0  0  0  0
  5 21  1  0  0  0  0
 21 22  2  0  0  0  0
 21 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 31 33  1  0  0  0  0
 33 34  1  0  0  0  0
 33 35  1  0  0  0  0
 28 35  1  0  0  0  0
 35 36  1  0  0  0  0
 35 37  1  0  0  0  0
 37 38  1  0  0  0  0
 37 39  1  0  0  0  0
 27 40  2  0  0  0  0
 23 40  1  0  0  0  0
 40 41  1  0  0  0  0
 24 42  1  0  0  0  0
  4 42  1  0  0  0  0
 42 43  2  0  0  0  0
M  END
> <DATABASE_ID>
NP0275915

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CC1OC1C1OC1(C)C1=CC(=O)C2=C(C)C=C3C(=O)C4=C(C(O)=C(C=C4)C4OCC(C)C(O)C4(C)N(C)C)C(=O)C3=C2O1

> <INCHI_IDENTIFIER>
InChI=1S/C33H35NO9/c1-13-10-18-23(28-21(13)19(35)11-20(42-28)33(5)31(43-33)27-15(3)41-27)26(38)22-16(24(18)36)8-9-17(25(22)37)30-32(4,34(6)7)29(39)14(2)12-40-30/h8-11,14-15,27,29-31,37,39H,12H2,1-7H3

> <INCHI_KEY>
VAWJCVXSOVKIMR-UHFFFAOYSA-N

> <FORMULA>
C33H35NO9

> <MOLECULAR_WEIGHT>
589.641

> <EXACT_MASS>
589.231181711

> <JCHEM_ACCEPTOR_COUNT>
10

> <JCHEM_ATOM_COUNT>
78

> <JCHEM_AVERAGE_POLARIZABILITY>
62.09382395491254

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
2

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
2-{3,3'-dimethyl-[2,2'-bioxirane]-3-yl}-10-[3-(dimethylamino)-4-hydroxy-3,5-dimethyloxan-2-yl]-11-hydroxy-5-methyl-7,12-dihydro-4H-1-oxatetraphene-4,7,12-trione

> <JCHEM_LOGP>
3.5177191305008413

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
7

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
12.892390587653566

> <JCHEM_PKA_STRONGEST_ACIDIC>
7.4261357879685415

> <JCHEM_PKA_STRONGEST_BASIC>
6.331473100775677

> <JCHEM_POLAR_SURFACE_AREA>
138.43

> <JCHEM_REFRACTIVITY>
157.53039999999996

> <JCHEM_ROTATABLE_BOND_COUNT>
4

> <JCHEM_RULE_OF_FIVE>
0

> <JCHEM_TRADITIONAL_IUPAC>
2-{3,3'-dimethyl-[2,2'-bioxirane]-3-yl}-10-[3-(dimethylamino)-4-hydroxy-3,5-dimethyloxan-2-yl]-11-hydroxy-5-methyl-1-oxatetraphene-4,7,12-trione

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 09-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   09-SEP-22         0                                  
HETATM    1  C   UNK     0       8.391  -3.304   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       7.383  -2.140   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       5.870  -2.431   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       4.862  -1.267   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       5.366   0.188   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       6.879   0.479   0.000  0.00  0.00           C+0
HETATM    7  O   UNK     0       7.383   1.934   0.000  0.00  0.00           O+0
HETATM    8  C   UNK     0       8.895   2.225   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       9.399   3.680   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      10.920   3.437   0.000  0.00  0.00           C+0
HETATM   11  O   UNK     0       8.053   4.429   0.000  0.00  0.00           O+0
HETATM   12  C   UNK     0       9.375   5.220   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      10.124   6.566   0.000  0.00  0.00           C+0
HETATM   14  O   UNK     0      10.100   8.105   0.000  0.00  0.00           O+0
HETATM   15  C   UNK     0      11.446   7.356   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      12.985   7.380   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       9.903   1.061   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       9.399  -0.394   0.000  0.00  0.00           C+0
HETATM   19  O   UNK     0      10.407  -1.558   0.000  0.00  0.00           O+0
HETATM   20  C   UNK     0       7.887  -0.685   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       4.358   1.352   0.000  0.00  0.00           C+0
HETATM   22  O   UNK     0       4.862   2.807   0.000  0.00  0.00           O+0
HETATM   23  C   UNK     0       2.846   1.061   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0       2.342  -0.394   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0       0.830  -0.685   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0      -0.179   0.479   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0       0.326   1.934   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0      -0.683   3.098   0.000  0.00  0.00           C+0
HETATM   29  O   UNK     0      -2.195   2.807   0.000  0.00  0.00           O+0
HETATM   30  C   UNK     0      -3.203   3.971   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0      -2.699   5.427   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0      -3.707   6.591   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0      -1.187   5.718   0.000  0.00  0.00           C+0
HETATM   34  O   UNK     0      -0.683   7.173   0.000  0.00  0.00           O+0
HETATM   35  C   UNK     0      -0.179   4.553   0.000  0.00  0.00           C+0
HETATM   36  C   UNK     0       1.293   4.100   0.000  0.00  0.00           C+0
HETATM   37  N   UNK     0       1.020   5.520   0.000  0.00  0.00           N+0
HETATM   38  C   UNK     0       2.457   4.966   0.000  0.00  0.00           C+0
HETATM   39  C   UNK     0       0.782   7.042   0.000  0.00  0.00           C+0
HETATM   40  C   UNK     0       1.838   2.225   0.000  0.00  0.00           C+0
HETATM   41  O   UNK     0       2.342   3.680   0.000  0.00  0.00           O+0
HETATM   42  C   UNK     0       3.350  -1.558   0.000  0.00  0.00           C+0
HETATM   43  O   UNK     0       2.846  -3.013   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3   20                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5   42                                                  
CONECT    5    4    6   21                                                  
CONECT    6    5    7   20                                                  
CONECT    7    6    8                                                       
CONECT    8    7    9   17                                                  
CONECT    9    8   10   11   12                                             
CONECT   10    9                                                            
CONECT   11    9   12                                                       
CONECT   12   11    9   13                                                  
CONECT   13   12   14   15                                                  
CONECT   14   13   15                                                       
CONECT   15   14   13   16                                                  
CONECT   16   15                                                            
CONECT   17    8   18                                                       
CONECT   18   17   19   20                                                  
CONECT   19   18                                                            
CONECT   20   18    2    6                                                  
CONECT   21    5   22   23                                                  
CONECT   22   21                                                            
CONECT   23   21   24   40                                                  
CONECT   24   23   25   42                                                  
CONECT   25   24   26                                                       
CONECT   26   25   27                                                       
CONECT   27   26   28   40                                                  
CONECT   28   27   29   35                                                  
CONECT   29   28   30                                                       
CONECT   30   29   31                                                       
CONECT   31   30   32   33                                                  
CONECT   32   31                                                            
CONECT   33   31   34   35                                                  
CONECT   34   33                                                            
CONECT   35   33   28   36   37                                             
CONECT   36   35                                                            
CONECT   37   35   38   39                                                  
CONECT   38   37                                                            
CONECT   39   37                                                            
CONECT   40   27   23   41                                                  
CONECT   41   40                                                            
CONECT   42   24    4   43                                                  
CONECT   43   42                                                            
MASTER        0    0    0    0    0    0    0    0   43    0   98    0
END

View in JSmol

Synonyms

Value	Source
Ankinomycin	MeSH

Chemical Formula

C₃₃H₃₅NO₉

Average Mass

589.6410 Da

Monoisotopic Mass

589.23118 Da

IUPAC Name

2-{3,3'-dimethyl-[2,2'-bioxirane]-3-yl}-10-[3-(dimethylamino)-4-hydroxy-3,5-dimethyloxan-2-yl]-11-hydroxy-5-methyl-7,12-dihydro-4H-1-oxatetraphene-4,7,12-trione

Traditional Name

2-{3,3'-dimethyl-[2,2'-bioxirane]-3-yl}-10-[3-(dimethylamino)-4-hydroxy-3,5-dimethyloxan-2-yl]-11-hydroxy-5-methyl-1-oxatetraphene-4,7,12-trione

CAS Registry Number

Not Available

SMILES

CC1OC1C1OC1(C)C1=CC(=O)C2=C(C)C=C3C(=O)C4=C(C(O)=C(C=C4)C4OCC(C)C(O)C4(C)N(C)C)C(=O)C3=C2O1

InChI Identifier

InChI=1S/C33H35NO9/c1-13-10-18-23(28-21(13)19(35)11-20(42-28)33(5)31(43-33)27-15(3)41-27)26(38)22-16(24(18)36)8-9-17(25(22)37)30-32(4,34(6)7)29(39)14(2)12-40-30/h8-11,14-15,27,29-31,37,39H,12H2,1-7H3

InChI Key

VAWJCVXSOVKIMR-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 anthraquinones. These are organic compounds containing either anthracene-9,10-quinone, 1,4-anthraquinone, or 1,2-anthraquinone.

Kingdom

Super Class

Class

Sub Class

Direct Parent

Alternative Parents

Substituents

Anthraquinone
9,10-anthraquinone
Naphthopyranone
Naphthopyran
Chromone
1-benzopyran
Benzopyran
Aryl ketone
1-hydroxy-4-unsubstituted benzenoid
Aralkylamine
Pyranone
Pyran
Oxane
Heteroaromatic compound
Vinylogous acid
Tertiary aliphatic amine
Tertiary amine
Secondary alcohol
Ketone
1,2-aminoalcohol
Oxacycle
Organoheterocyclic compound
Ether
Oxirane
Dialkyl ether
Organic nitrogen compound
Organic oxygen compound
Organopnictogen compound
Organic oxide
Hydrocarbon derivative
Organooxygen compound
Organonitrogen compound
Amine
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	3.52	ChemAxon
pKa (Strongest Acidic)	7.43	ChemAxon
pKa (Strongest Basic)	6.33	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	10	ChemAxon
Hydrogen Donor Count	2	ChemAxon
Polar Surface Area	138.43 Å²	ChemAxon
Rotatable Bond Count	4	ChemAxon
Refractivity	157.53 m³·mol⁻¹	ChemAxon
Polarizability	62.09 Å³	ChemAxon
Number of Rings	7	ChemAxon
Bioavailability	Yes	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

143920

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

164119

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

LOTUS database [Link]

Showing NP-Card for 2-{3,3'-dimethyl-[2,2'-bioxiran]-3-yl}-10-[3-(dimethylamino)-4-hydroxy-3,5-dimethyloxan-2-yl]-11-hydroxy-5-methyl-1-oxatetraphene-4,7,12-trione (NP0275915)

MOL for NP0275915 (2-{3,3'-dimethyl-[2,2'-bioxiran]-3-yl}-10-[3-(dimethylamino)-4-hydroxy-3,5-dimethyloxan-2-yl]-11-hydroxy-5-methyl-1-oxatetraphene-4,7,12-trione)

3D MOL for NP0275915 (2-{3,3'-dimethyl-[2,2'-bioxiran]-3-yl}-10-[3-(dimethylamino)-4-hydroxy-3,5-dimethyloxan-2-yl]-11-hydroxy-5-methyl-1-oxatetraphene-4,7,12-trione)

3D SDF for NP0275915 (2-{3,3'-dimethyl-[2,2'-bioxiran]-3-yl}-10-[3-(dimethylamino)-4-hydroxy-3,5-dimethyloxan-2-yl]-11-hydroxy-5-methyl-1-oxatetraphene-4,7,12-trione)

3D-SDF for NP0275915 (2-{3,3'-dimethyl-[2,2'-bioxiran]-3-yl}-10-[3-(dimethylamino)-4-hydroxy-3,5-dimethyloxan-2-yl]-11-hydroxy-5-methyl-1-oxatetraphene-4,7,12-trione)

PDB for NP0275915 (2-{3,3'-dimethyl-[2,2'-bioxiran]-3-yl}-10-[3-(dimethylamino)-4-hydroxy-3,5-dimethyloxan-2-yl]-11-hydroxy-5-methyl-1-oxatetraphene-4,7,12-trione)

3D PDB for NP0275915 (2-{3,3'-dimethyl-[2,2'-bioxiran]-3-yl}-10-[3-(dimethylamino)-4-hydroxy-3,5-dimethyloxan-2-yl]-11-hydroxy-5-methyl-1-oxatetraphene-4,7,12-trione)

SMILES for NP0275915 (2-{3,3'-dimethyl-[2,2'-bioxiran]-3-yl}-10-[3-(dimethylamino)-4-hydroxy-3,5-dimethyloxan-2-yl]-11-hydroxy-5-methyl-1-oxatetraphene-4,7,12-trione)

INCHI for NP0275915 (2-{3,3'-dimethyl-[2,2'-bioxiran]-3-yl}-10-[3-(dimethylamino)-4-hydroxy-3,5-dimethyloxan-2-yl]-11-hydroxy-5-methyl-1-oxatetraphene-4,7,12-trione)

Structure for NP0275915 (2-{3,3'-dimethyl-[2,2'-bioxiran]-3-yl}-10-[3-(dimethylamino)-4-hydroxy-3,5-dimethyloxan-2-yl]-11-hydroxy-5-methyl-1-oxatetraphene-4,7,12-trione)

3D Structure for NP0275915 (2-{3,3'-dimethyl-[2,2'-bioxiran]-3-yl}-10-[3-(dimethylamino)-4-hydroxy-3,5-dimethyloxan-2-yl]-11-hydroxy-5-methyl-1-oxatetraphene-4,7,12-trione)