NP-MRD: Showing NP-Card for [3,5-bis(acetyloxy)-2,9-dihydroxy-6,10,14,14-tetramethyl-12-oxo-15,17-dioxapentacyclo[7.6.1.1¹,⁴.0⁴,⁸.0¹³,¹⁶]heptadec-6-en-2-yl]methyl acetate (NP0285783)

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Record Information

Version

2.0

Created at

2022-09-09 14:05:55 UTC

Updated at

2022-09-09 14:05:55 UTC

NP-MRD ID

NP0285783

Secondary Accession Numbers

None

Natural Product Identification

Common Name

[3,5-bis(acetyloxy)-2,9-dihydroxy-6,10,14,14-tetramethyl-12-oxo-15,17-dioxapentacyclo[7.6.1.1¹,⁴.0⁴,⁸.0¹³,¹⁶]heptadec-6-en-2-yl]methyl acetate

Description

[3,5-Bis(acetyloxy)-2,9-dihydroxy-6,10,14,14-tetramethyl-12-oxo-15,17-dioxapentacyclo[7.6.1.1¹,⁴.0⁴,⁸.0¹³,¹⁶]Heptadec-6-en-2-yl]methyl acetate belongs to the class of organic compounds known as furopyrans. These are organic polycyclic compounds containing a furan ring fused to a pyran ring. Furan is a five-membered aromatic ring with four carbon atoms and one oxygen atom. Pyran a six-membered heterocyclic, non-aromatic ring, made up of five carbon atoms and one oxygen atom and containing two double bonds. [3,5-bis(acetyloxy)-2,9-dihydroxy-6,10,14,14-tetramethyl-12-oxo-15,17-dioxapentacyclo[7.6.1.1¹,⁴.0⁴,⁸.0¹³,¹⁶]heptadec-6-en-2-yl]methyl acetate is found in Neoboutonia mannii. [3,5-Bis(acetyloxy)-2,9-dihydroxy-6,10,14,14-tetramethyl-12-oxo-15,17-dioxapentacyclo[7.6.1.1¹,⁴.0⁴,⁸.0¹³,¹⁶]Heptadec-6-en-2-yl]methyl acetate is an extremely weak basic (essentially neutral) compound (based on its pKa).

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1533004171513052D          

 37 41  0  0  0  0            999 V2000
    3.3019    1.4673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6273    0.9925    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8779    1.3479    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1927    0.8724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4522    1.2361    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2358    0.0292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9926   -0.3143    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7098    0.1577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4120    0.5908    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4440   -0.3067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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M  END

     RDKit          3D

 71 75  0  0  0  0  0  0  0  0999 V2000
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M  END


  Mrv1533004171513052D          

 37 41  0  0  0  0            999 V2000
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    3.3086   -3.4396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4876   -3.5205    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7892   -4.1102    0.0000 C   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  2  0  0  0  0
  4  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  2  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 12 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 16 18  1  0  0  0  0
 14 19  1  0  0  0  0
 10 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
  7 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
  6 23  1  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  0  0  0  0
 21 26  1  0  0  0  0
 26 27  1  0  0  0  0
 26 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 30 32  1  0  0  0  0
 26 33  1  0  0  0  0
 19 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  2  0  0  0  0
 35 37  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0285783

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CC1CC(=O)C2C3C4(OC2(C)C)OC2(C(OC(C)=O)C(C)=CC2C13O)C(OC(C)=O)C4(O)COC(C)=O

> <INCHI_IDENTIFIER>
InChI=1S/C26H34O11/c1-11-8-17-24(32)12(2)9-16(30)18-19(24)26(36-22(18,6)7)23(31,10-33-13(3)27)21(35-15(5)29)25(17,37-26)20(11)34-14(4)28/h8,12,17-21,31-32H,9-10H2,1-7H3

> <INCHI_KEY>
YEEOCARHOXSUFN-UHFFFAOYSA-N

> <FORMULA>
C26H34O11

> <MOLECULAR_WEIGHT>
522.547

> <EXACT_MASS>
522.210111915

> <JCHEM_ACCEPTOR_COUNT>
8

> <JCHEM_ATOM_COUNT>
71

> <JCHEM_AVERAGE_POLARIZABILITY>
52.62424654869453

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
2

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
[3,5-bis(acetyloxy)-2,9-dihydroxy-6,10,14,14-tetramethyl-12-oxo-15,17-dioxapentacyclo[7.6.1.1¹,⁴.0⁴,⁸.0¹³,¹⁶]heptadec-6-en-2-yl]methyl acetate

> <ALOGPS_LOGP>
1.25

> <JCHEM_LOGP>
-0.046290016666667246

> <ALOGPS_LOGS>
-2.65

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
5

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
13.370948368692414

> <JCHEM_PKA_STRONGEST_ACIDIC>
11.164695832337602

> <JCHEM_PKA_STRONGEST_BASIC>
-3.326499809213974

> <JCHEM_POLAR_SURFACE_AREA>
154.89

> <JCHEM_REFRACTIVITY>
122.6991

> <JCHEM_ROTATABLE_BOND_COUNT>
7

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.16e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
[3,5-bis(acetyloxy)-2,9-dihydroxy-6,10,14,14-tetramethyl-12-oxo-15,17-dioxapentacyclo[7.6.1.1¹,⁴.0⁴,⁸.0¹³,¹⁶]heptadec-6-en-2-yl]methyl acetate

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 17-APR-15   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   17-APR-15         0                                  
HETATM    1  C   UNK     0       6.164   2.739   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       4.904   1.853   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       3.505   2.516   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       2.226   1.628   0.000  0.00  0.00           C+0
HETATM    5  O   UNK     0       0.844   2.307   0.000  0.00  0.00           O+0
HETATM    6  C   UNK     0       2.307   0.055   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       3.719  -0.587   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       5.058   0.294   0.000  0.00  0.00           C+0
HETATM    9  O   UNK     0       6.369   1.103   0.000  0.00  0.00           O+0
HETATM   10  C   UNK     0       6.429  -0.572   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       7.882   0.014   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       8.871  -1.169   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      10.408  -1.072   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       8.031  -2.481   0.000  0.00  0.00           C+0
HETATM   15  O   UNK     0       8.648  -3.892   0.000  0.00  0.00           O+0
HETATM   16  C   UNK     0      10.179  -4.063   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0      11.092  -2.823   0.000  0.00  0.00           O+0
HETATM   18  C   UNK     0      10.796  -5.474   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       6.453  -2.201   0.000  0.00  0.00           C+0
HETATM   20  O   UNK     0       5.038  -2.155   0.000  0.00  0.00           O+0
HETATM   21  C   UNK     0       3.678  -2.222   0.000  0.00  0.00           C+0
HETATM   22  O   UNK     0       2.120  -2.494   0.000  0.00  0.00           O+0
HETATM   23  C   UNK     0       1.311  -1.162   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0       0.023  -0.317   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      -0.082  -1.818   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0       4.288  -3.773   0.000  0.00  0.00           C+0
HETATM   27  O   UNK     0       4.484  -5.300   0.000  0.00  0.00           O+0
HETATM   28  C   UNK     0       2.796  -4.155   0.000  0.00  0.00           C+0
HETATM   29  O   UNK     0       2.381  -5.638   0.000  0.00  0.00           O+0
HETATM   30  C   UNK     0       0.890  -6.021   0.000  0.00  0.00           C+0
HETATM   31  O   UNK     0      -0.188  -4.921   0.000  0.00  0.00           O+0
HETATM   32  C   UNK     0       0.475  -7.504   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0       5.915  -3.766   0.000  0.00  0.00           C+0
HETATM   34  O   UNK     0       6.812  -5.018   0.000  0.00  0.00           O+0
HETATM   35  C   UNK     0       6.176  -6.421   0.000  0.00  0.00           C+0
HETATM   36  O   UNK     0       4.644  -6.572   0.000  0.00  0.00           O+0
HETATM   37  C   UNK     0       7.073  -7.672   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3    8                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5    6                                                  
CONECT    5    4                                                            
CONECT    6    4    7   23                                                  
CONECT    7    6    8   21                                                  
CONECT    8    7    2    9   10                                             
CONECT    9    8                                                            
CONECT   10    8   11   19                                                  
CONECT   11   10   12                                                       
CONECT   12   11   13   14                                                  
CONECT   13   12                                                            
CONECT   14   12   15   19                                                  
CONECT   15   14   16                                                       
CONECT   16   15   17   18                                                  
CONECT   17   16                                                            
CONECT   18   16                                                            
CONECT   19   14   10   20   33                                             
CONECT   20   19   21                                                       
CONECT   21   20    7   22   26                                             
CONECT   22   21   23                                                       
CONECT   23   22    6   24   25                                             
CONECT   24   23                                                            
CONECT   25   23                                                            
CONECT   26   21   27   28   33                                             
CONECT   27   26                                                            
CONECT   28   26   29                                                       
CONECT   29   28   30                                                       
CONECT   30   29   31   32                                                  
CONECT   31   30                                                            
CONECT   32   30                                                            
CONECT   33   26   19   34                                                  
CONECT   34   33   35                                                       
CONECT   35   34   36   37                                                  
CONECT   36   35                                                            
CONECT   37   35                                                            
MASTER        0    0    0    0    0    0    0    0   37    0   82    0
END

View in JSmol

Synonyms

Value	Source
[3,5-Bis(acetyloxy)-2,9-dihydroxy-6,10,14,14-tetramethyl-12-oxo-15,17-dioxapentacyclo[7.6.1.1,.0,.0,]heptadec-6-en-2-yl]methyl acetic acid	Generator
[3,5-Bis(acetyloxy)-2,9-dihydroxy-6,10,14,14-tetramethyl-12-oxo-15,17-dioxapentacyclo[7.6.1.1¹,⁴.0⁴,⁸.0¹³,¹⁶]heptadec-6-en-2-yl]methyl acetic acid	Generator

Chemical Formula

C₂₆H₃₄O₁₁

Average Mass

522.5470 Da

Monoisotopic Mass

522.21011 Da

IUPAC Name

[3,5-bis(acetyloxy)-2,9-dihydroxy-6,10,14,14-tetramethyl-12-oxo-15,17-dioxapentacyclo[7.6.1.1¹,⁴.0⁴,⁸.0¹³,¹⁶]heptadec-6-en-2-yl]methyl acetate

Traditional Name

[3,5-bis(acetyloxy)-2,9-dihydroxy-6,10,14,14-tetramethyl-12-oxo-15,17-dioxapentacyclo[7.6.1.1¹,⁴.0⁴,⁸.0¹³,¹⁶]heptadec-6-en-2-yl]methyl acetate

CAS Registry Number

Not Available

SMILES

CC1CC(=O)C2C3C4(OC2(C)C)OC2(C(OC(C)=O)C(C)=CC2C13O)C(OC(C)=O)C4(O)COC(C)=O

InChI Identifier

InChI=1S/C26H34O11/c1-11-8-17-24(32)12(2)9-16(30)18-19(24)26(36-22(18,6)7)23(31,10-33-13(3)27)21(35-15(5)29)25(17,37-26)20(11)34-14(4)28/h8,12,17-21,31-32H,9-10H2,1-7H3

InChI Key

YEEOCARHOXSUFN-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
Neoboutonia mannii	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as furopyrans. These are organic polycyclic compounds containing a furan ring fused to a pyran ring. Furan is a five-membered aromatic ring with four carbon atoms and one oxygen atom. Pyran a six-membered heterocyclic, non-aromatic ring, made up of five carbon atoms and one oxygen atom and containing two double bonds.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Furopyrans

Sub Class

Not Available

Direct Parent

Furopyrans

Alternative Parents

Substituents

Furopyran
Tricarboxylic acid or derivatives
Ketal
Monosaccharide
Pyran
Oxane
Cyclic alcohol
Furan
Tetrahydrofuran
Tertiary alcohol
Carboxylic acid ester
Ketone
Acetal
Carboxylic acid derivative
Oxacycle
Alcohol
Hydrocarbon derivative
Organic oxide
Organic oxygen compound
Carbonyl group
Organooxygen compound
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	1.25	ALOGPS
logP	-0.046	ChemAxon
logS	-2.6	ALOGPS
pKa (Strongest Acidic)	11.16	ChemAxon
pKa (Strongest Basic)	-3.3	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	8	ChemAxon
Hydrogen Donor Count	2	ChemAxon
Polar Surface Area	154.89 Å²	ChemAxon
Rotatable Bond Count	7	ChemAxon
Refractivity	122.7 m³·mol⁻¹	ChemAxon
Polarizability	52.62 Å³	ChemAxon
Number of Rings	5	ChemAxon
Bioavailability	Yes	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

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 [3,5-bis(acetyloxy)-2,9-dihydroxy-6,10,14,14-tetramethyl-12-oxo-15,17-dioxapentacyclo[7.6.1.1¹,⁴.0⁴,⁸.0¹³,¹⁶]heptadec-6-en-2-yl]methyl acetate (NP0285783)

MOL for NP0285783 ([3,5-bis(acetyloxy)-2,9-dihydroxy-6,10,14,14-tetramethyl-12-oxo-15,17-dioxapentacyclo[7.6.1.1¹,⁴.0⁴,⁸.0¹³,¹⁶]heptadec-6-en-2-yl]methyl acetate)

3D MOL for NP0285783 ([3,5-bis(acetyloxy)-2,9-dihydroxy-6,10,14,14-tetramethyl-12-oxo-15,17-dioxapentacyclo[7.6.1.1¹,⁴.0⁴,⁸.0¹³,¹⁶]heptadec-6-en-2-yl]methyl acetate)

3D SDF for NP0285783 ([3,5-bis(acetyloxy)-2,9-dihydroxy-6,10,14,14-tetramethyl-12-oxo-15,17-dioxapentacyclo[7.6.1.1¹,⁴.0⁴,⁸.0¹³,¹⁶]heptadec-6-en-2-yl]methyl acetate)

3D-SDF for NP0285783 ([3,5-bis(acetyloxy)-2,9-dihydroxy-6,10,14,14-tetramethyl-12-oxo-15,17-dioxapentacyclo[7.6.1.1¹,⁴.0⁴,⁸.0¹³,¹⁶]heptadec-6-en-2-yl]methyl acetate)

PDB for NP0285783 ([3,5-bis(acetyloxy)-2,9-dihydroxy-6,10,14,14-tetramethyl-12-oxo-15,17-dioxapentacyclo[7.6.1.1¹,⁴.0⁴,⁸.0¹³,¹⁶]heptadec-6-en-2-yl]methyl acetate)

3D PDB for NP0285783 ([3,5-bis(acetyloxy)-2,9-dihydroxy-6,10,14,14-tetramethyl-12-oxo-15,17-dioxapentacyclo[7.6.1.1¹,⁴.0⁴,⁸.0¹³,¹⁶]heptadec-6-en-2-yl]methyl acetate)

SMILES for NP0285783 ([3,5-bis(acetyloxy)-2,9-dihydroxy-6,10,14,14-tetramethyl-12-oxo-15,17-dioxapentacyclo[7.6.1.1¹,⁴.0⁴,⁸.0¹³,¹⁶]heptadec-6-en-2-yl]methyl acetate)

INCHI for NP0285783 ([3,5-bis(acetyloxy)-2,9-dihydroxy-6,10,14,14-tetramethyl-12-oxo-15,17-dioxapentacyclo[7.6.1.1¹,⁴.0⁴,⁸.0¹³,¹⁶]heptadec-6-en-2-yl]methyl acetate)

Structure for NP0285783 ([3,5-bis(acetyloxy)-2,9-dihydroxy-6,10,14,14-tetramethyl-12-oxo-15,17-dioxapentacyclo[7.6.1.1¹,⁴.0⁴,⁸.0¹³,¹⁶]heptadec-6-en-2-yl]methyl acetate)

3D Structure for NP0285783 ([3,5-bis(acetyloxy)-2,9-dihydroxy-6,10,14,14-tetramethyl-12-oxo-15,17-dioxapentacyclo[7.6.1.1¹,⁴.0⁴,⁸.0¹³,¹⁶]heptadec-6-en-2-yl]methyl acetate)