NP-MRD: Showing NP-Card for 2-[(1s,2r,5s,7r,11s,14s)-11-hydroxy-1,2-dimethyl-8-oxo-6-oxa-23-azahexacyclo[12.10.0.0²,¹¹.0⁵,¹⁰.0¹⁶,²⁴.0¹⁷,²²]tetracosa-9,16(24),17,19,21-pentaen-7-yl]propan-2-yl acetate (NP0324757)

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Record Information

Version

2.0

Created at

2022-09-12 05:01:43 UTC

Updated at

2022-09-12 05:01:43 UTC

NP-MRD ID

NP0324757

Secondary Accession Numbers

None

Natural Product Identification

Common Name

2-[(1s,2r,5s,7r,11s,14s)-11-hydroxy-1,2-dimethyl-8-oxo-6-oxa-23-azahexacyclo[12.10.0.0²,¹¹.0⁵,¹⁰.0¹⁶,²⁴.0¹⁷,²²]tetracosa-9,16(24),17,19,21-pentaen-7-yl]propan-2-yl acetate

Description

1'-O-Acetylpaxilline belongs to the class of organic compounds known as naphthopyrans. Naphthopyrans are compounds containing a pyran ring fused to a naphthalene moiety. Furan is a 6 membered-ring non-aromatic ring with five carbon and one oxygen atoms. Naphthalene is a polycyclic aromatic hydrocarbon made up of two fused benzene rings. 2-[(1s,2r,5s,7r,11s,14s)-11-hydroxy-1,2-dimethyl-8-oxo-6-oxa-23-azahexacyclo[12.10.0.0²,¹¹.0⁵,¹⁰.0¹⁶,²⁴.0¹⁷,²²]tetracosa-9,16(24),17,19,21-pentaen-7-yl]propan-2-yl acetate is found in Aspergillus desertorum. 1'-O-Acetylpaxilline is an extremely weak basic (essentially neutral) compound (based on its pKa).

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv0541 01111302312D          

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M  END

     RDKit          3D

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M  END


  Mrv0541 01111302312D          

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   -1.2772   -9.1693    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  1  6  2  0  0  0  0
  7  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6 12  1  0  0  0  0
  7 11  1  0  0  0  0
  9  8  1  0  0  0  0
  8 12  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 13  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 14  1  0  0  0  0
 15 16  1  0  0  0  0
 13 16  1  0  0  0  0
 15 20  1  0  0  0  0
 15 14  1  0  0  0  0
 14 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 21 20  2  0  0  0  0
 20 19  1  0  0  0  0
 19 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 21 24  1  0  0  0  0
 24 25  2  0  0  0  0
 23 26  1  6  0  0  0
 26 27  1  0  0  0  0
 26 28  1  0  0  0  0
 26 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 30 32  2  0  0  0  0
  9 33  1  6  0  0  0
 10 34  1  1  0  0  0
 14 35  1  6  0  0  0
 15 36  1  1  0  0  0
 19 37  1  1  0  0  0
M  END
> <DATABASE_ID>
NP0324757

> <DATABASE_NAME>
NP-MRD

> <SMILES>
[H][C@]12CC3=C(NC4=CC=CC=C34)[C@]1(C)[C@@]1(C)CC[C@]3([H])O[C@@H](C(=O)C=C3[C@]1(O)CC2)C(C)(C)OC(C)=O

> <INCHI_IDENTIFIER>
InChI=1S/C29H35NO5/c1-16(31)35-26(2,3)25-22(32)15-20-23(34-25)11-12-27(4)28(5)17(10-13-29(20,27)33)14-19-18-8-6-7-9-21(18)30-24(19)28/h6-9,15,17,23,25,30,33H,10-14H2,1-5H3/t17-,23-,25-,27+,28+,29+/m0/s1

> <INCHI_KEY>
OHPVFSRTGKOAHP-FPCGACKZSA-N

> <FORMULA>
C29H35NO5

> <MOLECULAR_WEIGHT>
477.5919

> <EXACT_MASS>
477.251523235

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_AVERAGE_POLARIZABILITY>
54.544288254101815

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
2

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
2-[(1S,2R,5S,7R,11S,14S)-11-hydroxy-1,2-dimethyl-8-oxo-6-oxa-23-azahexacyclo[12.10.0.0²,¹¹.0⁵,¹⁰.0¹⁶,²⁴.0¹⁷,²²]tetracosa-9,16(24),17,19,21-pentaen-7-yl]propan-2-yl acetate

> <ALOGPS_LOGP>
4.79

> <JCHEM_LOGP>
4.064208670999999

> <ALOGPS_LOGS>
-6.02

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
6

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
16.85957474932692

> <JCHEM_PKA_STRONGEST_ACIDIC>
13.69407507563908

> <JCHEM_PKA_STRONGEST_BASIC>
-3.369867568600613

> <JCHEM_POLAR_SURFACE_AREA>
88.62000000000002

> <JCHEM_REFRACTIVITY>
132.36800000000002

> <JCHEM_ROTATABLE_BOND_COUNT>
3

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
4.58e-04 g/l

> <JCHEM_TRADITIONAL_IUPAC>
2-[(1S,2R,5S,7R,11S,14S)-11-hydroxy-1,2-dimethyl-8-oxo-6-oxa-23-azahexacyclo[12.10.0.0²,¹¹.0⁵,¹⁰.0¹⁶,²⁴.0¹⁷,²²]tetracosa-9,16(24),17,19,21-pentaen-7-yl]propan-2-yl acetate

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 11-JAN-13   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   11-JAN-13         0                                  
HETATM    1  C   UNK     0     -13.053 -23.276   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0     -14.387 -22.506   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0     -14.387 -20.966   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0     -13.053 -20.196   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0     -11.720 -20.966   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0     -11.720 -22.506   0.000  0.00  0.00           C+0
HETATM    7  N   UNK     0     -10.386 -20.196   0.000  0.00  0.00           N+0
HETATM    8  C   UNK     0      -7.719 -23.276   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      -6.385 -22.506   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      -6.385 -20.966   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -9.052 -20.966   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      -9.052 -22.506   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      -5.051 -23.276   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      -5.051 -20.196   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      -3.718 -20.966   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      -3.718 -22.506   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      -5.051 -18.656   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      -3.718 -17.886   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      -2.384 -18.656   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      -2.384 -20.196   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      -1.050 -20.966   0.000  0.00  0.00           C+0
HETATM   22  O   UNK     0      -1.050 -17.886   0.000  0.00  0.00           O+0
HETATM   23  C   UNK     0       0.283 -18.656   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0       0.283 -20.196   0.000  0.00  0.00           C+0
HETATM   25  O   UNK     0       1.617 -20.966   0.000  0.00  0.00           O+0
HETATM   26  C   UNK     0       1.617 -17.886   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0       2.951 -18.656   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0       1.617 -16.346   0.000  0.00  0.00           C+0
HETATM   29  O   UNK     0       2.951 -17.116   0.000  0.00  0.00           O+0
HETATM   30  C   UNK     0       4.284 -17.886   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0       5.618 -17.116   0.000  0.00  0.00           C+0
HETATM   32  O   UNK     0       4.284 -19.426   0.000  0.00  0.00           O+0
HETATM   33  H   UNK     0      -6.385 -24.046   0.000  0.00  0.00           H+0
HETATM   34  C   UNK     0      -6.385 -19.426   0.000  0.00  0.00           C+0
HETATM   35  C   UNK     0      -5.051 -21.736   0.000  0.00  0.00           C+0
HETATM   36  O   UNK     0      -3.718 -19.426   0.000  0.00  0.00           O+0
HETATM   37  H   UNK     0      -2.384 -17.116   0.000  0.00  0.00           H+0
CONECT    1    2    6                                                       
CONECT    2    1    3                                                       
CONECT    3    2    4                                                       
CONECT    4    3    5                                                       
CONECT    5    4    7    6                                                  
CONECT    6    1    5   12                                                  
CONECT    7    5   11                                                       
CONECT    8    9   12                                                       
CONECT    9    8   13   10   33                                             
CONECT   10   11    9   14   34                                             
CONECT   11    7   10   12                                                  
CONECT   12    6    8   11                                                  
CONECT   13    9   16                                                       
CONECT   14   10   15   17   35                                             
CONECT   15   16   20   14   36                                             
CONECT   16   15   13                                                       
CONECT   17   14   18                                                       
CONECT   18   17   19                                                       
CONECT   19   18   20   22   37                                             
CONECT   20   15   21   19                                                  
CONECT   21   20   24                                                       
CONECT   22   19   23                                                       
CONECT   23   22   24   26                                                  
CONECT   24   23   21   25                                                  
CONECT   25   24                                                            
CONECT   26   23   27   28   29                                             
CONECT   27   26                                                            
CONECT   28   26                                                            
CONECT   29   26   30                                                       
CONECT   30   29   31   32                                                  
CONECT   31   30                                                            
CONECT   32   30                                                            
CONECT   33    9                                                            
CONECT   34   10                                                            
CONECT   35   14                                                            
CONECT   36   15                                                            
CONECT   37   19                                                            
MASTER        0    0    0    0    0    0    0    0   37    0   84    0
END

View in JSmol

Synonyms

Value	Source
2-[(1S,2R,5S,7R,11S,14S)-11-Hydroxy-1,2-dimethyl-8-oxo-6-oxa-23-azahexacyclo[12.10.0.0²,¹¹.0⁵,¹⁰.0¹⁶,²⁴.0¹⁷,²²]tetracosa-9,16(24),17,19,21-pentaen-7-yl]propan-2-yl acetic acid	Generator
1'-O-Acetylpaxilline	MeSH

Chemical Formula

C₂₉H₃₅NO₅

Average Mass

477.5919 Da

Monoisotopic Mass

477.25152 Da

IUPAC Name

2-[(1S,2R,5S,7R,11S,14S)-11-hydroxy-1,2-dimethyl-8-oxo-6-oxa-23-azahexacyclo[12.10.0.0²,¹¹.0⁵,¹⁰.0¹⁶,²⁴.0¹⁷,²²]tetracosa-9,16(24),17,19,21-pentaen-7-yl]propan-2-yl acetate

Traditional Name

2-[(1S,2R,5S,7R,11S,14S)-11-hydroxy-1,2-dimethyl-8-oxo-6-oxa-23-azahexacyclo[12.10.0.0²,¹¹.0⁵,¹⁰.0¹⁶,²⁴.0¹⁷,²²]tetracosa-9,16(24),17,19,21-pentaen-7-yl]propan-2-yl acetate

CAS Registry Number

Not Available

SMILES

[H][C@]12CC3=C(NC4=CC=CC=C34)[C@]1(C)[C@@]1(C)CC[C@]3([H])O[C@@H](C(=O)C=C3[C@]1(O)CC2)C(C)(C)OC(C)=O

InChI Identifier

InChI=1S/C29H35NO5/c1-16(31)35-26(2,3)25-22(32)15-20-23(34-25)11-12-27(4)28(5)17(10-13-29(20,27)33)14-19-18-8-6-7-9-21(18)30-24(19)28/h6-9,15,17,23,25,30,33H,10-14H2,1-5H3/t17-,23-,25-,27+,28+,29+/m0/s1

InChI Key

OHPVFSRTGKOAHP-FPCGACKZSA-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
Emericella desertorum	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as naphthopyrans. Naphthopyrans are compounds containing a pyran ring fused to a naphthalene moiety. Furan is a 6 membered-ring non-aromatic ring with five carbon and one oxygen atoms. Naphthalene is a polycyclic aromatic hydrocarbon made up of two fused benzene rings.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Naphthopyrans

Sub Class

Not Available

Direct Parent

Naphthopyrans

Alternative Parents

Substituents

Naphthopyran
Naphthalene
3-alkylindole
Indole
Indole or derivatives
Dihydropyranone
Pyran
Benzenoid
Cyclic alcohol
Pyrrole
Heteroaromatic compound
Tertiary alcohol
Carboxylic acid ester
Ketone
Cyclic ketone
Monocarboxylic acid or derivatives
Azacycle
Ether
Dialkyl ether
Oxacycle
Carboxylic acid derivative
Organonitrogen compound
Hydrocarbon derivative
Organic oxide
Organopnictogen compound
Organic oxygen compound
Organic nitrogen compound
Organooxygen compound
Alcohol
Carbonyl group
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	4.79	ALOGPS
logP	4.06	ChemAxon
logS	-6	ALOGPS
pKa (Strongest Acidic)	13.69	ChemAxon
pKa (Strongest Basic)	-3.4	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	4	ChemAxon
Hydrogen Donor Count	2	ChemAxon
Polar Surface Area	88.62 Å²	ChemAxon
Rotatable Bond Count	3	ChemAxon
Refractivity	132.37 m³·mol⁻¹	ChemAxon
Polarizability	54.54 Å³	ChemAxon
Number of Rings	6	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

External Links

HMDB ID

HMDB0037530

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

FDB016611

KNApSAcK ID

Not Available

Chemspider ID

2339244

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

3081700

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

LOTUS database [Link]

Showing NP-Card for 2-[(1s,2r,5s,7r,11s,14s)-11-hydroxy-1,2-dimethyl-8-oxo-6-oxa-23-azahexacyclo[12.10.0.0²,¹¹.0⁵,¹⁰.0¹⁶,²⁴.0¹⁷,²²]tetracosa-9,16(24),17,19,21-pentaen-7-yl]propan-2-yl acetate (NP0324757)

MOL for NP0324757 (2-[(1s,2r,5s,7r,11s,14s)-11-hydroxy-1,2-dimethyl-8-oxo-6-oxa-23-azahexacyclo[12.10.0.0²,¹¹.0⁵,¹⁰.0¹⁶,²⁴.0¹⁷,²²]tetracosa-9,16(24),17,19,21-pentaen-7-yl]propan-2-yl acetate)

3D MOL for NP0324757 (2-[(1s,2r,5s,7r,11s,14s)-11-hydroxy-1,2-dimethyl-8-oxo-6-oxa-23-azahexacyclo[12.10.0.0²,¹¹.0⁵,¹⁰.0¹⁶,²⁴.0¹⁷,²²]tetracosa-9,16(24),17,19,21-pentaen-7-yl]propan-2-yl acetate)

3D SDF for NP0324757 (2-[(1s,2r,5s,7r,11s,14s)-11-hydroxy-1,2-dimethyl-8-oxo-6-oxa-23-azahexacyclo[12.10.0.0²,¹¹.0⁵,¹⁰.0¹⁶,²⁴.0¹⁷,²²]tetracosa-9,16(24),17,19,21-pentaen-7-yl]propan-2-yl acetate)

3D-SDF for NP0324757 (2-[(1s,2r,5s,7r,11s,14s)-11-hydroxy-1,2-dimethyl-8-oxo-6-oxa-23-azahexacyclo[12.10.0.0²,¹¹.0⁵,¹⁰.0¹⁶,²⁴.0¹⁷,²²]tetracosa-9,16(24),17,19,21-pentaen-7-yl]propan-2-yl acetate)

PDB for NP0324757 (2-[(1s,2r,5s,7r,11s,14s)-11-hydroxy-1,2-dimethyl-8-oxo-6-oxa-23-azahexacyclo[12.10.0.0²,¹¹.0⁵,¹⁰.0¹⁶,²⁴.0¹⁷,²²]tetracosa-9,16(24),17,19,21-pentaen-7-yl]propan-2-yl acetate)

3D PDB for NP0324757 (2-[(1s,2r,5s,7r,11s,14s)-11-hydroxy-1,2-dimethyl-8-oxo-6-oxa-23-azahexacyclo[12.10.0.0²,¹¹.0⁵,¹⁰.0¹⁶,²⁴.0¹⁷,²²]tetracosa-9,16(24),17,19,21-pentaen-7-yl]propan-2-yl acetate)

SMILES for NP0324757 (2-[(1s,2r,5s,7r,11s,14s)-11-hydroxy-1,2-dimethyl-8-oxo-6-oxa-23-azahexacyclo[12.10.0.0²,¹¹.0⁵,¹⁰.0¹⁶,²⁴.0¹⁷,²²]tetracosa-9,16(24),17,19,21-pentaen-7-yl]propan-2-yl acetate)

INCHI for NP0324757 (2-[(1s,2r,5s,7r,11s,14s)-11-hydroxy-1,2-dimethyl-8-oxo-6-oxa-23-azahexacyclo[12.10.0.0²,¹¹.0⁵,¹⁰.0¹⁶,²⁴.0¹⁷,²²]tetracosa-9,16(24),17,19,21-pentaen-7-yl]propan-2-yl acetate)

Structure for NP0324757 (2-[(1s,2r,5s,7r,11s,14s)-11-hydroxy-1,2-dimethyl-8-oxo-6-oxa-23-azahexacyclo[12.10.0.0²,¹¹.0⁵,¹⁰.0¹⁶,²⁴.0¹⁷,²²]tetracosa-9,16(24),17,19,21-pentaen-7-yl]propan-2-yl acetate)

3D Structure for NP0324757 (2-[(1s,2r,5s,7r,11s,14s)-11-hydroxy-1,2-dimethyl-8-oxo-6-oxa-23-azahexacyclo[12.10.0.0²,¹¹.0⁵,¹⁰.0¹⁶,²⁴.0¹⁷,²²]tetracosa-9,16(24),17,19,21-pentaen-7-yl]propan-2-yl acetate)