NP-MRD: Showing NP-Card for (1r,2s,3s,4r,8r,10s,12r,13r,15r,17r)-13-(furan-3-yl)-4,10-dihydroxy-15-isopropyl-5,7,7,12-tetramethyl-9,14,19,20-tetraoxahexacyclo[8.7.1.1¹,⁴.1²,¹⁵.0³,⁸.0¹²,¹⁷]icos-5-en-3-yl acetate (NP0318537)

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Record Information

Version

2.0

Created at

2022-09-11 19:05:46 UTC

Updated at

2022-09-11 19:05:46 UTC

NP-MRD ID

NP0318537

Secondary Accession Numbers

None

Natural Product Identification

Common Name

(1r,2s,3s,4r,8r,10s,12r,13r,15r,17r)-13-(furan-3-yl)-4,10-dihydroxy-15-isopropyl-5,7,7,12-tetramethyl-9,14,19,20-tetraoxahexacyclo[8.7.1.1¹,⁴.1²,¹⁵.0³,⁸.0¹²,¹⁷]icos-5-en-3-yl acetate

Description

Entilin B 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. (1r,2s,3s,4r,8r,10s,12r,13r,15r,17r)-13-(furan-3-yl)-4,10-dihydroxy-15-isopropyl-5,7,7,12-tetramethyl-9,14,19,20-tetraoxahexacyclo[8.7.1.1¹,⁴.1²,¹⁵.0³,⁸.0¹²,¹⁷]icos-5-en-3-yl acetate is found in Entandrophragma utile. (1r,2s,3s,4r,8r,10s,12r,13r,15r,17r)-13-(furan-3-yl)-4,10-dihydroxy-15-isopropyl-5,7,7,12-tetramethyl-9,14,19,20-tetraoxahexacyclo[8.7.1.1¹,⁴.1²,¹⁵.0³,⁸.0¹²,¹⁷]icos-5-en-3-yl acetate was first documented in 2018 (PMID: 28987553). Based on a literature review very few articles have been published on Entilin B.

Structure

MOL 3D MOL SDF PDB SMILES InChI


  Mrv1652309112221052D          

 38 44  0  0  1  0            999 V2000
    1.5498    1.0266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  5 36  1  0  0  0  0
 36 37  1  1  0  0  0
 36 38  1  0  0  0  0
 14 38  1  0  0  0  0
M  END

     RDKit          3D

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M  END


  Mrv1652309112221052D          

 38 44  0  0  1  0            999 V2000
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    6.5300   -3.5850    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7310   -3.3796    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0705   -1.1854    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7559   -2.6516    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6843   -1.6430    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.0477   -0.9194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2075   -0.1100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4712   -0.3293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4643   -1.5200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8987   -2.2443    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5640   -2.9984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8145   -2.0634    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.5397   -2.8413    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5200   -2.2404    0.0000 O   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
  2  4  1  0  0  0  0
  5  4  1  1  0  0  0
  5  6  1  0  0  0  0
  6  7  1  1  0  0  0
  7  8  1  0  0  0  0
  8  9  1  1  0  0  0
  9 10  1  0  0  0  0
  9 11  1  0  0  0  0
  8 12  1  0  0  0  0
 13 12  1  6  0  0  0
 13 14  1  0  0  0  0
  6 14  1  0  0  0  0
 14 15  1  6  0  0  0
 15 16  1  0  0  0  0
 16 17  1  1  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 13 19  1  0  0  0  0
 19 20  1  1  0  0  0
 19 21  1  0  0  0  0
 21 22  1  1  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 22 26  2  0  0  0  0
 21 27  1  0  0  0  0
  8 27  1  0  0  0  0
 16 28  1  0  0  0  0
 29 28  1  6  0  0  0
  5 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 30 32  1  0  0  0  0
 30 33  1  0  0  0  0
 33 34  2  0  0  0  0
 34 35  1  0  0  0  0
 34 36  1  0  0  0  0
  5 36  1  0  0  0  0
 36 37  1  1  0  0  0
 36 38  1  0  0  0  0
 14 38  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0318537

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CC(C)[C@]12C[C@H]3[C@]45C[C@](O)(C[C@@]3(C)[C@@H](O1)C1=COC=C1)O[C@H]1[C@](OC(C)=O)([C@H]4O2)[C@](O)(O5)C(C)=CC1(C)C

> <INCHI_IDENTIFIER>
InChI=1S/C29H38O9/c1-15(2)27-11-19-24(7,20(35-27)18-8-9-33-12-18)13-25(31)14-26(19)22(37-27)28(34-17(4)30)21(36-25)23(5,6)10-16(3)29(28,32)38-26/h8-10,12,15,19-22,31-32H,11,13-14H2,1-7H3/t19-,20+,21-,22+,24-,25+,26-,27-,28+,29-/m1/s1

> <INCHI_KEY>
MQGQZGHRAMJAAF-GBYJIVAESA-N

> <FORMULA>
C29H38O9

> <MOLECULAR_WEIGHT>
530.614

> <EXACT_MASS>
530.251582804

> <JCHEM_ACCEPTOR_COUNT>
7

> <JCHEM_ATOM_COUNT>
76

> <JCHEM_AVERAGE_POLARIZABILITY>
55.3231695673248

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
2

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(1R,2S,3S,4R,8R,10S,12R,13R,15R,17R)-13-(furan-3-yl)-4,10-dihydroxy-5,7,7,12-tetramethyl-15-(propan-2-yl)-9,14,19,20-tetraoxahexacyclo[8.7.1.1^{1,4}.1^{2,15}.0^{3,8}.0^{12,17}]icos-5-en-3-yl acetate

> <JCHEM_LOGP>
3.843256652000001

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
7

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
11.944897768239708

> <JCHEM_PKA_STRONGEST_ACIDIC>
10.25820630973934

> <JCHEM_PKA_STRONGEST_BASIC>
-2.838851142068104

> <JCHEM_POLAR_SURFACE_AREA>
116.82000000000002

> <JCHEM_REFRACTIVITY>
132.1726

> <JCHEM_ROTATABLE_BOND_COUNT>
4

> <JCHEM_RULE_OF_FIVE>
0

> <JCHEM_TRADITIONAL_IUPAC>
(1R,2S,3S,4R,8R,10S,12R,13R,15R,17R)-13-(furan-3-yl)-4,10-dihydroxy-15-isopropyl-5,7,7,12-tetramethyl-9,14,19,20-tetraoxahexacyclo[8.7.1.1^{1,4}.1^{2,15}.0^{3,8}.0^{12,17}]icos-5-en-3-yl acetate

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 11-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   11-SEP-22         0                                  
HETATM    1  C   UNK     0       2.893   1.916   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       3.708   0.610   0.000  0.00  0.00           C+0
HETATM    3  O   UNK     0       5.247   0.662   0.000  0.00  0.00           O+0
HETATM    4  O   UNK     0       2.984  -0.749   0.000  0.00  0.00           O+0
HETATM    5  C   UNK     0       3.799  -2.056   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       5.293  -1.876   0.000  0.00  0.00           C+0
HETATM    7  O   UNK     0       6.480  -0.682   0.000  0.00  0.00           O+0
HETATM    8  C   UNK     0       8.149  -1.072   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       8.849   0.300   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      10.387   0.380   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       8.011   1.592   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       7.893  -2.134   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       7.182  -3.554   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       5.891  -3.269   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       5.420  -4.883   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       4.761  -5.779   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0       4.256  -7.234   0.000  0.00  0.00           O+0
HETATM   18  C   UNK     0       6.533  -6.061   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       7.858  -4.798   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       8.787  -6.027   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       9.301  -3.946   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      10.601  -4.772   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      12.033  -4.205   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      13.015  -5.392   0.000  0.00  0.00           C+0
HETATM   25  O   UNK     0      12.189  -6.692   0.000  0.00  0.00           O+0
HETATM   26  C   UNK     0      10.698  -6.309   0.000  0.00  0.00           C+0
HETATM   27  O   UNK     0       9.465  -2.213   0.000  0.00  0.00           O+0
HETATM   28  O   UNK     0       3.278  -4.950   0.000  0.00  0.00           O+0
HETATM   29  C   UNK     0       3.144  -3.067   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0       1.956  -1.716   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0       2.254  -0.205   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0       0.880  -0.615   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0       0.867  -2.837   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0       1.678  -4.189   0.000  0.00  0.00           C+0
HETATM   35  C   UNK     0       1.053  -5.597   0.000  0.00  0.00           C+0
HETATM   36  C   UNK     0       3.387  -3.852   0.000  0.00  0.00           C+0
HETATM   37  O   UNK     0       2.874  -5.304   0.000  0.00  0.00           O+0
HETATM   38  O   UNK     0       4.704  -4.182   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3    4                                                  
CONECT    3    2                                                            
CONECT    4    2    5                                                       
CONECT    5    4    6   29   36                                             
CONECT    6    5    7   14                                                  
CONECT    7    6    8                                                       
CONECT    8    7    9   12   27                                             
CONECT    9    8   10   11                                                  
CONECT   10    9                                                            
CONECT   11    9                                                            
CONECT   12    8   13                                                       
CONECT   13   12   14   19                                                  
CONECT   14   13    6   15   38                                             
CONECT   15   14   16                                                       
CONECT   16   15   17   18   28                                             
CONECT   17   16                                                            
CONECT   18   16   19                                                       
CONECT   19   18   13   20   21                                             
CONECT   20   19                                                            
CONECT   21   19   22   27                                                  
CONECT   22   21   23   26                                                  
CONECT   23   22   24                                                       
CONECT   24   23   25                                                       
CONECT   25   24   26                                                       
CONECT   26   25   22                                                       
CONECT   27   21    8                                                       
CONECT   28   16   29                                                       
CONECT   29   28    5   30                                                  
CONECT   30   29   31   32   33                                             
CONECT   31   30                                                            
CONECT   32   30                                                            
CONECT   33   30   34                                                       
CONECT   34   33   35   36                                                  
CONECT   35   34                                                            
CONECT   36   34    5   37   38                                             
CONECT   37   36                                                            
CONECT   38   36   14                                                       
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

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

CC(C)[C@]12C[C@H]3[C@]45C[C@](O)(C[C@@]3(C)[C@@H](O1)C1=COC=C1)O[C@H]1[C@](OC(C)=O)([C@H]4O2)[C@](O)(O5)C(C)=CC1(C)C

InChI Identifier

InChI=1S/C29H38O9/c1-15(2)27-11-19-24(7,20(35-27)18-8-9-33-12-18)13-25(31)14-26(19)22(37-27)28(34-17(4)30)21(36-25)23(5,6)10-16(3)29(28,32)38-26/h8-10,12,15,19-22,31-32H,11,13-14H2,1-7H3/t19-,20+,21-,22+,24-,25+,26-,27-,28+,29-/m1/s1

InChI Key

MQGQZGHRAMJAAF-GBYJIVAESA-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
Entandrophragma utile	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
Ketal
Oxepane
Pyran
Oxane
Monosaccharide
Cyclic alcohol
Furan
Heteroaromatic compound
Tetrahydrofuran
Carboxylic acid ester
Hemiacetal
Acetal
Carboxylic acid derivative
Oxacycle
Monocarboxylic acid or derivatives
Organic oxide
Organic oxygen compound
Hydrocarbon derivative
Carbonyl group
Organooxygen compound
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

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

4579679

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

5469124

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Happi GM, Talontsi FM, Laatsch H, Zuhlke S, Ngadjui BT, Spiteller M, Kouam SF: seco-Tiaminic acids B and C: Identification of two novel 3,4-seco-tirucallane triterpenoids isolated from the root of Entandrophragma congoense (Meliaceae). Fitoterapia. 2018 Jan;124:17-22. doi: 10.1016/j.fitote.2017.10.004. Epub 2017 Oct 5. [PubMed:28987553 ]
LOTUS database [Link]

Showing NP-Card for (1r,2s,3s,4r,8r,10s,12r,13r,15r,17r)-13-(furan-3-yl)-4,10-dihydroxy-15-isopropyl-5,7,7,12-tetramethyl-9,14,19,20-tetraoxahexacyclo[8.7.1.1¹,⁴.1²,¹⁵.0³,⁸.0¹²,¹⁷]icos-5-en-3-yl acetate (NP0318537)

MOL for NP0318537 ((1r,2s,3s,4r,8r,10s,12r,13r,15r,17r)-13-(furan-3-yl)-4,10-dihydroxy-15-isopropyl-5,7,7,12-tetramethyl-9,14,19,20-tetraoxahexacyclo[8.7.1.1¹,⁴.1²,¹⁵.0³,⁸.0¹²,¹⁷]icos-5-en-3-yl acetate)

3D MOL for NP0318537 ((1r,2s,3s,4r,8r,10s,12r,13r,15r,17r)-13-(furan-3-yl)-4,10-dihydroxy-15-isopropyl-5,7,7,12-tetramethyl-9,14,19,20-tetraoxahexacyclo[8.7.1.1¹,⁴.1²,¹⁵.0³,⁸.0¹²,¹⁷]icos-5-en-3-yl acetate)

3D SDF for NP0318537 ((1r,2s,3s,4r,8r,10s,12r,13r,15r,17r)-13-(furan-3-yl)-4,10-dihydroxy-15-isopropyl-5,7,7,12-tetramethyl-9,14,19,20-tetraoxahexacyclo[8.7.1.1¹,⁴.1²,¹⁵.0³,⁸.0¹²,¹⁷]icos-5-en-3-yl acetate)

3D-SDF for NP0318537 ((1r,2s,3s,4r,8r,10s,12r,13r,15r,17r)-13-(furan-3-yl)-4,10-dihydroxy-15-isopropyl-5,7,7,12-tetramethyl-9,14,19,20-tetraoxahexacyclo[8.7.1.1¹,⁴.1²,¹⁵.0³,⁸.0¹²,¹⁷]icos-5-en-3-yl acetate)

PDB for NP0318537 ((1r,2s,3s,4r,8r,10s,12r,13r,15r,17r)-13-(furan-3-yl)-4,10-dihydroxy-15-isopropyl-5,7,7,12-tetramethyl-9,14,19,20-tetraoxahexacyclo[8.7.1.1¹,⁴.1²,¹⁵.0³,⁸.0¹²,¹⁷]icos-5-en-3-yl acetate)

3D PDB for NP0318537 ((1r,2s,3s,4r,8r,10s,12r,13r,15r,17r)-13-(furan-3-yl)-4,10-dihydroxy-15-isopropyl-5,7,7,12-tetramethyl-9,14,19,20-tetraoxahexacyclo[8.7.1.1¹,⁴.1²,¹⁵.0³,⁸.0¹²,¹⁷]icos-5-en-3-yl acetate)

SMILES for NP0318537 ((1r,2s,3s,4r,8r,10s,12r,13r,15r,17r)-13-(furan-3-yl)-4,10-dihydroxy-15-isopropyl-5,7,7,12-tetramethyl-9,14,19,20-tetraoxahexacyclo[8.7.1.1¹,⁴.1²,¹⁵.0³,⁸.0¹²,¹⁷]icos-5-en-3-yl acetate)

INCHI for NP0318537 ((1r,2s,3s,4r,8r,10s,12r,13r,15r,17r)-13-(furan-3-yl)-4,10-dihydroxy-15-isopropyl-5,7,7,12-tetramethyl-9,14,19,20-tetraoxahexacyclo[8.7.1.1¹,⁴.1²,¹⁵.0³,⁸.0¹²,¹⁷]icos-5-en-3-yl acetate)

Structure for NP0318537 ((1r,2s,3s,4r,8r,10s,12r,13r,15r,17r)-13-(furan-3-yl)-4,10-dihydroxy-15-isopropyl-5,7,7,12-tetramethyl-9,14,19,20-tetraoxahexacyclo[8.7.1.1¹,⁴.1²,¹⁵.0³,⁸.0¹²,¹⁷]icos-5-en-3-yl acetate)

3D Structure for NP0318537 ((1r,2s,3s,4r,8r,10s,12r,13r,15r,17r)-13-(furan-3-yl)-4,10-dihydroxy-15-isopropyl-5,7,7,12-tetramethyl-9,14,19,20-tetraoxahexacyclo[8.7.1.1¹,⁴.1²,¹⁵.0³,⁸.0¹²,¹⁷]icos-5-en-3-yl acetate)