NP-MRD: Showing NP-Card for (10s,12r,16s,20r,22r,24r,28s,32r,36r,40s)-40-tert-butyl-10,12,16,20,22,24,28,32,36-nonahydroxy-4-methyl-1-oxacyclotetracont-3-en-2-one (NP0212907)

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Record Information

Version

2.0

Created at

2022-09-05 11:43:06 UTC

Updated at

2022-09-05 11:43:06 UTC

NP-MRD ID

NP0212907

Secondary Accession Numbers

None

Natural Product Identification

Common Name

(10s,12r,16s,20r,22r,24r,28s,32r,36r,40s)-40-tert-butyl-10,12,16,20,22,24,28,32,36-nonahydroxy-4-methyl-1-oxacyclotetracont-3-en-2-one

Description

Bastimolide A belongs to the class of organic compounds known as macrolides and analogues. These are organic compounds containing a lactone ring of at least twelve members. (10s,12r,16s,20r,22r,24r,28s,32r,36r,40s)-40-tert-butyl-10,12,16,20,22,24,28,32,36-nonahydroxy-4-methyl-1-oxacyclotetracont-3-en-2-one is found in Okeania hirsuta. (10s,12r,16s,20r,22r,24r,28s,32r,36r,40s)-40-tert-butyl-10,12,16,20,22,24,28,32,36-nonahydroxy-4-methyl-1-oxacyclotetracont-3-en-2-one was first documented in 2015 (PMID: 26222145). Based on a literature review a small amount of articles have been published on Bastimolide A (PMID: 29327931) (PMID: 30129767) (PMID: 35608327).

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1652309052213432D          

 55 55  0  0  1  0            999 V2000
    6.8088    4.8447    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.1454    6.9277    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0784    5.5004    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
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  8 11  1  0  0  0  0
  7 12  1  0  0  0  0
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 33 35  1  0  0  0  0
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 36 37  1  6  0  0  0
 36 38  1  0  0  0  0
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 52 53  1  0  0  0  0
 53 54  1  0  0  0  0
 54 55  1  0  0  0  0
  2 55  1  0  0  0  0
M  END

     RDKit          3D

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M  END


  Mrv1652309052213432D          

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M  END
> <DATABASE_ID>
NP0212907

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CC1=CC(=O)O[C@@H](CCC[C@H](O)CCC[C@H](O)CCC[C@H](O)CCC[C@@H](O)C[C@@H](O)C[C@H](O)CCC[C@@H](O)CCC[C@@H](O)C[C@@H](O)CCCCC1)C(C)(C)C

> <INCHI_IDENTIFIER>
InChI=1S/C44H84O11/c1-32-14-6-5-7-15-37(49)29-38(50)24-10-20-35(47)22-12-26-40(52)31-41(53)30-39(51)25-11-21-34(46)18-8-16-33(45)17-9-19-36(48)23-13-27-42(44(2,3)4)55-43(54)28-32/h28,33-42,45-53H,5-27,29-31H2,1-4H3/t33-,34+,35+,36-,37+,38-,39-,40-,41-,42+/m1/s1

> <INCHI_KEY>
GMYBARKHHWBGAC-LHLJFWNOSA-N

> <FORMULA>
C44H84O11

> <MOLECULAR_WEIGHT>
789.145

> <EXACT_MASS>
788.601363525

> <JCHEM_ACCEPTOR_COUNT>
10

> <JCHEM_ATOM_COUNT>
139

> <JCHEM_AVERAGE_POLARIZABILITY>
94.15574108043901

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
9

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(10S,12R,16S,20R,22R,24R,28S,32R,36R,40S)-40-tert-butyl-10,12,16,20,22,24,28,32,36-nonahydroxy-4-methyl-1-oxacyclotetracont-3-en-2-one

> <JCHEM_LOGP>
5.167195010333334

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
14.889054493806707

> <JCHEM_PKA_STRONGEST_ACIDIC>
14.461014783958557

> <JCHEM_PKA_STRONGEST_BASIC>
-0.7977503615656368

> <JCHEM_POLAR_SURFACE_AREA>
208.36999999999998

> <JCHEM_REFRACTIVITY>
219.42559999999997

> <JCHEM_ROTATABLE_BOND_COUNT>
1

> <JCHEM_RULE_OF_FIVE>
0

> <JCHEM_TRADITIONAL_IUPAC>
(10S,12R,16S,20R,22R,24R,28S,32R,36R,40S)-40-tert-butyl-10,12,16,20,22,24,28,32,36-nonahydroxy-4-methyl-1-oxacyclotetracont-3-en-2-one

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 05-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   05-SEP-22         0                                  
HETATM    1  C   UNK     0      12.710   9.043   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      12.003  10.412   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      12.835  11.708   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      14.373  11.636   0.000  0.00  0.00           C+0
HETATM    5  O   UNK     0      15.205  12.932   0.000  0.00  0.00           O+0
HETATM    6  O   UNK     0      15.080  10.267   0.000  0.00  0.00           O+0
HETATM    7  C   UNK     0      14.248   8.971   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      15.786   8.899   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      17.325   8.827   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      15.859  10.437   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      15.714   7.361   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      14.955   7.603   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      14.123   6.307   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      14.830   4.938   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      13.998   3.642   0.000  0.00  0.00           C+0
HETATM   16  O   UNK     0      12.460   3.715   0.000  0.00  0.00           O+0
HETATM   17  C   UNK     0      14.705   2.274   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      13.873   0.978   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      14.580  -0.390   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      13.748  -1.687   0.000  0.00  0.00           C+0
HETATM   21  O   UNK     0      12.210  -1.614   0.000  0.00  0.00           O+0
HETATM   22  C   UNK     0      14.455  -3.055   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      13.623  -4.351   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      14.330  -5.719   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      13.498  -7.015   0.000  0.00  0.00           C+0
HETATM   26  O   UNK     0      11.960  -6.943   0.000  0.00  0.00           O+0
HETATM   27  C   UNK     0      14.205  -8.384   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0      13.373  -9.680   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0      14.080 -11.048   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0      13.248 -12.344   0.000  0.00  0.00           C+0
HETATM   31  O   UNK     0      13.955 -13.713   0.000  0.00  0.00           O+0
HETATM   32  C   UNK     0      11.710 -12.272   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0      11.003 -10.904   0.000  0.00  0.00           C+0
HETATM   34  O   UNK     0      11.835  -9.608   0.000  0.00  0.00           O+0
HETATM   35  C   UNK     0       9.465 -10.832   0.000  0.00  0.00           C+0
HETATM   36  C   UNK     0       8.758  -9.463   0.000  0.00  0.00           C+0
HETATM   37  O   UNK     0       7.220  -9.391   0.000  0.00  0.00           O+0
HETATM   38  C   UNK     0       9.590  -8.167   0.000  0.00  0.00           C+0
HETATM   39  C   UNK     0       8.883  -6.799   0.000  0.00  0.00           C+0
HETATM   40  C   UNK     0       9.715  -5.503   0.000  0.00  0.00           C+0
HETATM   41  C   UNK     0       9.008  -4.134   0.000  0.00  0.00           C+0
HETATM   42  O   UNK     0       7.470  -4.062   0.000  0.00  0.00           O+0
HETATM   43  C   UNK     0       9.840  -2.838   0.000  0.00  0.00           C+0
HETATM   44  C   UNK     0       9.133  -1.470   0.000  0.00  0.00           C+0
HETATM   45  C   UNK     0       9.965  -0.174   0.000  0.00  0.00           C+0
HETATM   46  C   UNK     0       9.258   1.194   0.000  0.00  0.00           C+0
HETATM   47  O   UNK     0       7.720   1.267   0.000  0.00  0.00           O+0
HETATM   48  C   UNK     0      10.090   2.491   0.000  0.00  0.00           C+0
HETATM   49  C   UNK     0       9.383   3.859   0.000  0.00  0.00           C+0
HETATM   50  O   UNK     0       7.845   3.931   0.000  0.00  0.00           O+0
HETATM   51  C   UNK     0      10.215   5.155   0.000  0.00  0.00           C+0
HETATM   52  C   UNK     0       9.508   6.523   0.000  0.00  0.00           C+0
HETATM   53  C   UNK     0      10.340   7.819   0.000  0.00  0.00           C+0
HETATM   54  C   UNK     0       9.633   9.188   0.000  0.00  0.00           C+0
HETATM   55  C   UNK     0      10.465  10.484   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3   55                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5    6                                                  
CONECT    5    4                                                            
CONECT    6    4    7                                                       
CONECT    7    6    8   12                                                  
CONECT    8    7    9   10   11                                             
CONECT    9    8                                                            
CONECT   10    8                                                            
CONECT   11    8                                                            
CONECT   12    7   13                                                       
CONECT   13   12   14                                                       
CONECT   14   13   15                                                       
CONECT   15   14   16   17                                                  
CONECT   16   15                                                            
CONECT   17   15   18                                                       
CONECT   18   17   19                                                       
CONECT   19   18   20                                                       
CONECT   20   19   21   22                                                  
CONECT   21   20                                                            
CONECT   22   20   23                                                       
CONECT   23   22   24                                                       
CONECT   24   23   25                                                       
CONECT   25   24   26   27                                                  
CONECT   26   25                                                            
CONECT   27   25   28                                                       
CONECT   28   27   29                                                       
CONECT   29   28   30                                                       
CONECT   30   29   31   32                                                  
CONECT   31   30                                                            
CONECT   32   30   33                                                       
CONECT   33   32   34   35                                                  
CONECT   34   33                                                            
CONECT   35   33   36                                                       
CONECT   36   35   37   38                                                  
CONECT   37   36                                                            
CONECT   38   36   39                                                       
CONECT   39   38   40                                                       
CONECT   40   39   41                                                       
CONECT   41   40   42   43                                                  
CONECT   42   41                                                            
CONECT   43   41   44                                                       
CONECT   44   43   45                                                       
CONECT   45   44   46                                                       
CONECT   46   45   47   48                                                  
CONECT   47   46                                                            
CONECT   48   46   49                                                       
CONECT   49   48   50   51                                                  
CONECT   50   49                                                            
CONECT   51   49   52                                                       
CONECT   52   51   53                                                       
CONECT   53   52   54                                                       
CONECT   54   53   55                                                       
CONECT   55   54    2                                                       
MASTER        0    0    0    0    0    0    0    0   55    0  110    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₄₄H₈₄O₁₁

Average Mass

789.1450 Da

Monoisotopic Mass

788.60136 Da

IUPAC Name

(10S,12R,16S,20R,22R,24R,28S,32R,36R,40S)-40-tert-butyl-10,12,16,20,22,24,28,32,36-nonahydroxy-4-methyl-1-oxacyclotetracont-3-en-2-one

Traditional Name

(10S,12R,16S,20R,22R,24R,28S,32R,36R,40S)-40-tert-butyl-10,12,16,20,22,24,28,32,36-nonahydroxy-4-methyl-1-oxacyclotetracont-3-en-2-one

CAS Registry Number

Not Available

SMILES

CC1=CC(=O)O[C@@H](CCC[C@H](O)CCC[C@H](O)CCC[C@H](O)CCC[C@@H](O)C[C@@H](O)C[C@H](O)CCC[C@@H](O)CCC[C@@H](O)C[C@@H](O)CCCCC1)C(C)(C)C

InChI Identifier

InChI=1S/C44H84O11/c1-32-14-6-5-7-15-37(49)29-38(50)24-10-20-35(47)22-12-26-40(52)31-41(53)30-39(51)25-11-21-34(46)18-8-16-33(45)17-9-19-36(48)23-13-27-42(44(2,3)4)55-43(54)28-32/h28,33-42,45-53H,5-27,29-31H2,1-4H3/t33-,34+,35+,36-,37+,38-,39-,40-,41-,42+/m1/s1

InChI Key

GMYBARKHHWBGAC-LHLJFWNOSA-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
Okeania hirsuta	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as macrolides and analogues. These are organic compounds containing a lactone ring of at least twelve members.

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Macrolides and analogues

Sub Class

Not Available

Direct Parent

Macrolides and analogues

Alternative Parents

Substituents

Macrolide
Alpha,beta-unsaturated carboxylic ester
Enoate ester
Secondary alcohol
Lactone
Carboxylic acid ester
Oxacycle
Organoheterocyclic compound
Polyol
Monocarboxylic acid or derivatives
Carboxylic acid derivative
Organic oxygen compound
Organic oxide
Hydrocarbon derivative
Organooxygen compound
Carbonyl group
Alcohol
Aliphatic heteromonocyclic compound

Molecular Framework

Aliphatic heteromonocyclic 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	5.17	ChemAxon
pKa (Strongest Acidic)	14.46	ChemAxon
pKa (Strongest Basic)	-0.8	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	10	ChemAxon
Hydrogen Donor Count	9	ChemAxon
Polar Surface Area	208.37 Å²	ChemAxon
Rotatable Bond Count	1	ChemAxon
Refractivity	219.43 m³·mol⁻¹	ChemAxon
Polarizability	94.16 Å³	ChemAxon
Number of Rings	1	ChemAxon
Bioavailability	No	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

145720608

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Shao CL, Linington RG, Balunas MJ, Centeno A, Boudreau P, Zhang C, Engene N, Spadafora C, Mutka TS, Kyle DE, Gerwick L, Wang CY, Gerwick WH: Bastimolide A, a Potent Antimalarial Polyhydroxy Macrolide from the Marine Cyanobacterium Okeania hirsuta. J Org Chem. 2015 Aug 21;80(16):7849-55. doi: 10.1021/acs.joc.5b01264. Epub 2015 Aug 5. [PubMed:26222145 ]
Shao CL, Mou XF, Cao F, Spadafora C, Glukhov E, Gerwick L, Wang CY, Gerwick WH: Bastimolide B, an Antimalarial 24-Membered Marine Macrolide Possessing a tert-Butyl Group. J Nat Prod. 2018 Jan 26;81(1):211-215. doi: 10.1021/acs.jnatprod.7b00917. Epub 2018 Jan 12. [PubMed:29327931 ]
Quintard A, Sperandio C, Rodriguez J: Modular Enantioselective Synthesis of an Advanced Pentahydroxy Intermediate of Antimalarial Bastimolide A and of Fluorinated and Chlorinated Analogues. Org Lett. 2018 Sep 7;20(17):5274-5277. doi: 10.1021/acs.orglett.8b02213. Epub 2018 Aug 21. [PubMed:30129767 ]
Cox JB, Kellum AA, Zhang Y, Li B, Smith AB 3rd: Total Synthesis of (-)-Bastimolide A: A Showcase for Type I Anion Relay Chemistry. Angew Chem Int Ed Engl. 2022 Jul 11;61(28):e202204884. doi: 10.1002/anie.202204884. Epub 2022 May 24. [PubMed:35608327 ]
LOTUS database [Link]

Showing NP-Card for (10s,12r,16s,20r,22r,24r,28s,32r,36r,40s)-40-tert-butyl-10,12,16,20,22,24,28,32,36-nonahydroxy-4-methyl-1-oxacyclotetracont-3-en-2-one (NP0212907)

MOL for NP0212907 ((10s,12r,16s,20r,22r,24r,28s,32r,36r,40s)-40-tert-butyl-10,12,16,20,22,24,28,32,36-nonahydroxy-4-methyl-1-oxacyclotetracont-3-en-2-one)

3D MOL for NP0212907 ((10s,12r,16s,20r,22r,24r,28s,32r,36r,40s)-40-tert-butyl-10,12,16,20,22,24,28,32,36-nonahydroxy-4-methyl-1-oxacyclotetracont-3-en-2-one)

3D SDF for NP0212907 ((10s,12r,16s,20r,22r,24r,28s,32r,36r,40s)-40-tert-butyl-10,12,16,20,22,24,28,32,36-nonahydroxy-4-methyl-1-oxacyclotetracont-3-en-2-one)

3D-SDF for NP0212907 ((10s,12r,16s,20r,22r,24r,28s,32r,36r,40s)-40-tert-butyl-10,12,16,20,22,24,28,32,36-nonahydroxy-4-methyl-1-oxacyclotetracont-3-en-2-one)

PDB for NP0212907 ((10s,12r,16s,20r,22r,24r,28s,32r,36r,40s)-40-tert-butyl-10,12,16,20,22,24,28,32,36-nonahydroxy-4-methyl-1-oxacyclotetracont-3-en-2-one)

3D PDB for NP0212907 ((10s,12r,16s,20r,22r,24r,28s,32r,36r,40s)-40-tert-butyl-10,12,16,20,22,24,28,32,36-nonahydroxy-4-methyl-1-oxacyclotetracont-3-en-2-one)

SMILES for NP0212907 ((10s,12r,16s,20r,22r,24r,28s,32r,36r,40s)-40-tert-butyl-10,12,16,20,22,24,28,32,36-nonahydroxy-4-methyl-1-oxacyclotetracont-3-en-2-one)

INCHI for NP0212907 ((10s,12r,16s,20r,22r,24r,28s,32r,36r,40s)-40-tert-butyl-10,12,16,20,22,24,28,32,36-nonahydroxy-4-methyl-1-oxacyclotetracont-3-en-2-one)

Structure for NP0212907 ((10s,12r,16s,20r,22r,24r,28s,32r,36r,40s)-40-tert-butyl-10,12,16,20,22,24,28,32,36-nonahydroxy-4-methyl-1-oxacyclotetracont-3-en-2-one)

3D Structure for NP0212907 ((10s,12r,16s,20r,22r,24r,28s,32r,36r,40s)-40-tert-butyl-10,12,16,20,22,24,28,32,36-nonahydroxy-4-methyl-1-oxacyclotetracont-3-en-2-one)