NP-MRD: Showing NP-Card for 2-hydroxy-9,9,18,21-tetramethyl-19-(4-methyl-5-oxooxolan-2-yl)-4,8,20,24-tetraoxahexacyclo[13.8.1.0¹,¹³.0³,⁷.0³,¹⁰.0¹⁷,²¹]tetracos-15-ene-5,14-dione (NP0268930)

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Record Information

Version

2.0

Created at

2022-09-08 14:12:46 UTC

Updated at

2022-09-08 14:12:46 UTC

NP-MRD ID

NP0268930

Secondary Accession Numbers

None

Natural Product Identification

Common Name

2-hydroxy-9,9,18,21-tetramethyl-19-(4-methyl-5-oxooxolan-2-yl)-4,8,20,24-tetraoxahexacyclo[13.8.1.0¹,¹³.0³,⁷.0³,¹⁰.0¹⁷,²¹]tetracos-15-ene-5,14-dione

Description

2-Hydroxy-9,9,18,21-tetramethyl-19-(4-methyl-5-oxooxolan-2-yl)-4,8,20,24-tetraoxahexacyclo[13.8.1.0¹,¹³.0³,⁷.0³,¹⁰.0¹⁷,²¹]Tetracos-15-ene-5,14-dione belongs to the class of organic compounds known as furofurans. These are organic compounds containing a two furan rings fused to each other. Furan is a five-membered aromatic ring with four carbon atoms and one oxygen atom. 2-hydroxy-9,9,18,21-tetramethyl-19-(4-methyl-5-oxooxolan-2-yl)-4,8,20,24-tetraoxahexacyclo[13.8.1.0¹,¹³.0³,⁷.0³,¹⁰.0¹⁷,²¹]tetracos-15-ene-5,14-dione is found in Schisandra arisanensis. 2-Hydroxy-9,9,18,21-tetramethyl-19-(4-methyl-5-oxooxolan-2-yl)-4,8,20,24-tetraoxahexacyclo[13.8.1.0¹,¹³.0³,⁷.0³,¹⁰.0¹⁷,²¹]Tetracos-15-ene-5,14-dione is an extremely weak basic (essentially neutral) compound (based on its pKa).

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1533004151514122D          

 38 44  0  0  0  0            999 V2000
    6.4411    2.6084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.0233    3.7090    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0385    0.9770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END

     RDKit          3D

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M  END


  Mrv1533004151514122D          

 38 44  0  0  0  0            999 V2000
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   -0.0901    0.4045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6697   -0.1827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7423    0.9097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3344    1.1137    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1319    0.8689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8109    1.3415    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4509    0.8236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6862    1.6143    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2608   -0.0582    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3027    0.0055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0218   -0.6262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8070   -0.3732    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  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  2  6  1  0  0  0  0
  6  7  2  0  0  0  0
  4  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 10 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
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  4  0  0  0
 10 18  1  0  0  0  0
 18 19  1  0  0  0  0
  8 19  1  0  0  0  0
 19 20  1  0  0  0  0
 16 21  1  0  0  0  0
 21 22  2  0  0  0  0
 21 23  1  0  0  0  0
 14 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
 27 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  2  0  0  0  0
 33 35  1  0  0  0  0
 35 36  1  0  0  0  0
 26 36  1  0  0  0  0
 31 36  1  0  0  0  0
 36 37  1  0  0  0  0
 14 37  1  0  0  0  0
 37 38  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0268930

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CC1CC(OC1=O)C1OC2(C)CCC34OC(=CC2C1C)C(=O)C3CCC1C(C)(C)OC2CC(=O)OC12C4O

> <INCHI_IDENTIFIER>
InChI=1S/C29H38O9/c1-13-10-18(34-24(13)32)23-14(2)16-11-17-22(31)15-6-7-19-26(3,4)36-20-12-21(30)37-29(19,20)25(33)28(15,35-17)9-8-27(16,5)38-23/h11,13-16,18-20,23,25,33H,6-10,12H2,1-5H3

> <INCHI_KEY>
UMKAINRVKDVUMT-UHFFFAOYSA-N

> <FORMULA>
C29H38O9

> <MOLECULAR_WEIGHT>
530.614

> <EXACT_MASS>
530.251582804

> <JCHEM_ACCEPTOR_COUNT>
7

> <JCHEM_ATOM_COUNT>
76

> <JCHEM_AVERAGE_POLARIZABILITY>
56.01547168560985

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
2-hydroxy-9,9,18,21-tetramethyl-19-(4-methyl-5-oxooxolan-2-yl)-4,8,20,24-tetraoxahexacyclo[13.8.1.0¹,¹³.0³,⁷.0³,¹⁰.0¹⁷,²¹]tetracos-15-ene-5,14-dione

> <ALOGPS_LOGP>
2.74

> <JCHEM_LOGP>
2.2589003523333315

> <ALOGPS_LOGS>
-4.09

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
7

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
17.71409437351171

> <JCHEM_PKA_STRONGEST_ACIDIC>
12.761406232035515

> <JCHEM_PKA_STRONGEST_BASIC>
-3.7779496194176785

> <JCHEM_POLAR_SURFACE_AREA>
117.59

> <JCHEM_REFRACTIVITY>
132.49280000000002

> <JCHEM_ROTATABLE_BOND_COUNT>
1

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
4.28e-02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
2-hydroxy-9,9,18,21-tetramethyl-19-(4-methyl-5-oxooxolan-2-yl)-4,8,20,24-tetraoxahexacyclo[13.8.1.0¹,¹³.0³,⁷.0³,¹⁰.0¹⁷,²¹]tetracos-15-ene-5,14-dione

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 15-APR-15   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   15-APR-15         0                                  
HETATM    1  C   UNK     0      12.023   4.869   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      10.544   4.440   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      10.022   2.991   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       8.483   3.040   0.000  0.00  0.00           C+0
HETATM    5  O   UNK     0       8.054   4.519   0.000  0.00  0.00           O+0
HETATM    6  C   UNK     0       9.328   5.384   0.000  0.00  0.00           C+0
HETATM    7  O   UNK     0       9.377   6.923   0.000  0.00  0.00           O+0
HETATM    8  C   UNK     0       7.539   1.824   0.000  0.00  0.00           C+0
HETATM    9  O   UNK     0       5.999   1.873   0.000  0.00  0.00           O+0
HETATM   10  C   UNK     0       5.477   0.424   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       5.038   1.900   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       3.701   0.456   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       2.832  -1.103   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       3.447  -2.591   0.000  0.00  0.00           C+0
HETATM   15  O   UNK     0       4.864  -2.939   0.000  0.00  0.00           O+0
HETATM   16  C   UNK     0       5.817  -3.599   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       6.838  -2.225   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       6.694  -0.520   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       7.968   0.345   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       9.416  -0.178   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       4.388  -4.626   0.000  0.00  0.00           C+0
HETATM   22  O   UNK     0       4.508  -6.161   0.000  0.00  0.00           O+0
HETATM   23  C   UNK     0       2.820  -3.835   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0       1.193  -3.423   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0       0.314  -2.053   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0       0.848  -0.522   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0      -0.168   0.755   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0      -1.250  -0.341   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0      -1.386   1.698   0.000  0.00  0.00           C+0
HETATM   30  O   UNK     0       0.624   2.079   0.000  0.00  0.00           O+0
HETATM   31  C   UNK     0       2.113   1.622   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0       3.380   2.504   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0       4.575   1.537   0.000  0.00  0.00           C+0
HETATM   34  O   UNK     0       5.014   3.013   0.000  0.00  0.00           O+0
HETATM   35  O   UNK     0       4.220  -0.109   0.000  0.00  0.00           O+0
HETATM   36  C   UNK     0       2.432   0.010   0.000  0.00  0.00           C+0
HETATM   37  C   UNK     0       3.774  -1.169   0.000  0.00  0.00           C+0
HETATM   38  O   UNK     0       5.240  -0.697   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3    6                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5    8                                                  
CONECT    5    4    6                                                       
CONECT    6    5    2    7                                                  
CONECT    7    6                                                            
CONECT    8    4    9   19                                                  
CONECT    9    8   10                                                       
CONECT   10    9   11   12   18                                             
CONECT   11   10                                                            
CONECT   12   10   13                                                       
CONECT   13   12   14                                                       
CONECT   14   13   15   23   37                                             
CONECT   15   14   16                                                       
CONECT   16   15   17   21                                                  
CONECT   17   16   18                                                       
CONECT   18   17   10   19                                                  
CONECT   19   18    8   20                                                  
CONECT   20   19                                                            
CONECT   21   16   22   23                                                  
CONECT   22   21                                                            
CONECT   23   21   14   24                                                  
CONECT   24   23   25                                                       
CONECT   25   24   26                                                       
CONECT   26   25   27   36                                                  
CONECT   27   26   28   29   30                                             
CONECT   28   27                                                            
CONECT   29   27                                                            
CONECT   30   27   31                                                       
CONECT   31   30   32   36                                                  
CONECT   32   31   33                                                       
CONECT   33   32   34   35                                                  
CONECT   34   33                                                            
CONECT   35   33   36                                                       
CONECT   36   35   26   31   37                                             
CONECT   37   36   14   38                                                  
CONECT   38   37                                                            
MASTER        0    0    0    0    0    0    0    0   38    0   88    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₂₉H₃₈O₉

Average Mass

530.6140 Da

Monoisotopic Mass

530.25158 Da

IUPAC Name

2-hydroxy-9,9,18,21-tetramethyl-19-(4-methyl-5-oxooxolan-2-yl)-4,8,20,24-tetraoxahexacyclo[13.8.1.0¹,¹³.0³,⁷.0³,¹⁰.0¹⁷,²¹]tetracos-15-ene-5,14-dione

Traditional Name

2-hydroxy-9,9,18,21-tetramethyl-19-(4-methyl-5-oxooxolan-2-yl)-4,8,20,24-tetraoxahexacyclo[13.8.1.0¹,¹³.0³,⁷.0³,¹⁰.0¹⁷,²¹]tetracos-15-ene-5,14-dione

CAS Registry Number

Not Available

SMILES

CC1CC(OC1=O)C1OC2(C)CCC34OC(=CC2C1C)C(=O)C3CCC1C(C)(C)OC2CC(=O)OC12C4O

InChI Identifier

InChI=1S/C29H38O9/c1-13-10-18(34-24(13)32)23-14(2)16-11-17-22(31)15-6-7-19-26(3,4)36-20-12-21(30)37-29(19,20)25(33)28(15,35-17)9-8-27(16,5)38-23/h11,13-16,18-20,23,25,33H,6-10,12H2,1-5H3

InChI Key

UMKAINRVKDVUMT-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
Schisandra arisanensis	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as furofurans. These are organic compounds containing a two furan rings fused to each other. Furan is a five-membered aromatic ring with four carbon atoms and one oxygen atom.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Furofurans

Sub Class

Not Available

Direct Parent

Furofurans

Alternative Parents

Substituents

Furofuran
Dicarboxylic acid or derivatives
3-furanone
Gamma butyrolactone
Cyclic alcohol
Tetrahydrofuran
Lactone
Ketone
Carboxylic acid ester
Secondary alcohol
Oxacycle
Ether
Dialkyl ether
Carboxylic acid derivative
Organooxygen compound
Hydrocarbon derivative
Organic oxide
Organic oxygen compound
Alcohol
Carbonyl group
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	2.74	ALOGPS
logP	2.26	ChemAxon
logS	-4.1	ALOGPS
pKa (Strongest Acidic)	12.76	ChemAxon
pKa (Strongest Basic)	-3.8	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	7	ChemAxon
Hydrogen Donor Count	1	ChemAxon
Polar Surface Area	117.59 Å²	ChemAxon
Rotatable Bond Count	1	ChemAxon
Refractivity	132.49 m³·mol⁻¹	ChemAxon
Polarizability	56.02 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

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

75097034

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

LOTUS database [Link]

Showing NP-Card for 2-hydroxy-9,9,18,21-tetramethyl-19-(4-methyl-5-oxooxolan-2-yl)-4,8,20,24-tetraoxahexacyclo[13.8.1.0¹,¹³.0³,⁷.0³,¹⁰.0¹⁷,²¹]tetracos-15-ene-5,14-dione (NP0268930)

MOL for NP0268930 (2-hydroxy-9,9,18,21-tetramethyl-19-(4-methyl-5-oxooxolan-2-yl)-4,8,20,24-tetraoxahexacyclo[13.8.1.0¹,¹³.0³,⁷.0³,¹⁰.0¹⁷,²¹]tetracos-15-ene-5,14-dione)

3D MOL for NP0268930 (2-hydroxy-9,9,18,21-tetramethyl-19-(4-methyl-5-oxooxolan-2-yl)-4,8,20,24-tetraoxahexacyclo[13.8.1.0¹,¹³.0³,⁷.0³,¹⁰.0¹⁷,²¹]tetracos-15-ene-5,14-dione)

3D SDF for NP0268930 (2-hydroxy-9,9,18,21-tetramethyl-19-(4-methyl-5-oxooxolan-2-yl)-4,8,20,24-tetraoxahexacyclo[13.8.1.0¹,¹³.0³,⁷.0³,¹⁰.0¹⁷,²¹]tetracos-15-ene-5,14-dione)

3D-SDF for NP0268930 (2-hydroxy-9,9,18,21-tetramethyl-19-(4-methyl-5-oxooxolan-2-yl)-4,8,20,24-tetraoxahexacyclo[13.8.1.0¹,¹³.0³,⁷.0³,¹⁰.0¹⁷,²¹]tetracos-15-ene-5,14-dione)

PDB for NP0268930 (2-hydroxy-9,9,18,21-tetramethyl-19-(4-methyl-5-oxooxolan-2-yl)-4,8,20,24-tetraoxahexacyclo[13.8.1.0¹,¹³.0³,⁷.0³,¹⁰.0¹⁷,²¹]tetracos-15-ene-5,14-dione)

3D PDB for NP0268930 (2-hydroxy-9,9,18,21-tetramethyl-19-(4-methyl-5-oxooxolan-2-yl)-4,8,20,24-tetraoxahexacyclo[13.8.1.0¹,¹³.0³,⁷.0³,¹⁰.0¹⁷,²¹]tetracos-15-ene-5,14-dione)

SMILES for NP0268930 (2-hydroxy-9,9,18,21-tetramethyl-19-(4-methyl-5-oxooxolan-2-yl)-4,8,20,24-tetraoxahexacyclo[13.8.1.0¹,¹³.0³,⁷.0³,¹⁰.0¹⁷,²¹]tetracos-15-ene-5,14-dione)

INCHI for NP0268930 (2-hydroxy-9,9,18,21-tetramethyl-19-(4-methyl-5-oxooxolan-2-yl)-4,8,20,24-tetraoxahexacyclo[13.8.1.0¹,¹³.0³,⁷.0³,¹⁰.0¹⁷,²¹]tetracos-15-ene-5,14-dione)

Structure for NP0268930 (2-hydroxy-9,9,18,21-tetramethyl-19-(4-methyl-5-oxooxolan-2-yl)-4,8,20,24-tetraoxahexacyclo[13.8.1.0¹,¹³.0³,⁷.0³,¹⁰.0¹⁷,²¹]tetracos-15-ene-5,14-dione)

3D Structure for NP0268930 (2-hydroxy-9,9,18,21-tetramethyl-19-(4-methyl-5-oxooxolan-2-yl)-4,8,20,24-tetraoxahexacyclo[13.8.1.0¹,¹³.0³,⁷.0³,¹⁰.0¹⁷,²¹]tetracos-15-ene-5,14-dione)