NP-MRD: Showing NP-Card for (1s,2r,4r,5s,7r,8r,12r,13r,20r,21r)-4-hydroxy-4,12-dimethyl-14,19-dioxa-17-azaheptacyclo[10.7.2.2²,⁵.0²,⁷.0⁸,¹⁸.0⁸,²¹.0¹³,¹⁷]tricosan-20-yl acetate (NP0244994)

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Record Information

Version

1.0

Created at

2022-09-07 05:55:09 UTC

Updated at

2022-09-07 05:55:09 UTC

NP-MRD ID

NP0244994

Secondary Accession Numbers

None

Natural Product Identification

Common Name

(1s,2r,4r,5s,7r,8r,12r,13r,20r,21r)-4-hydroxy-4,12-dimethyl-14,19-dioxa-17-azaheptacyclo[10.7.2.2²,⁵.0²,⁷.0⁸,¹⁸.0⁸,²¹.0¹³,¹⁷]tricosan-20-yl acetate

Description

Spiramine T belongs to the class of organic compounds known as atisane diterpenoids. These are diterpenoids with a structure based on the atisane skeleton, which is a tetracyclic compound containing the [2,2,2]bicyc1ic ring system with the C15-C16 bridge attached at C12. (1s,2r,4r,5s,7r,8r,12r,13r,20r,21r)-4-hydroxy-4,12-dimethyl-14,19-dioxa-17-azaheptacyclo[10.7.2.2²,⁵.0²,⁷.0⁸,¹⁸.0⁸,²¹.0¹³,¹⁷]tricosan-20-yl acetate is found in Spiraea japonica. It was first documented in 2001 (PMID: 11301860). Based on a literature review very few articles have been published on Spiramine T (PMID: 12106682).

Structure

MOL SDF PDB SMILES InChI


  Mrv1652309072207552D          

 30 36  0  0  1  0            999 V2000
    4.0087   -1.4577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1045   -0.6383    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8621   -0.3116    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4428   -0.1456    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5387    0.6738    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.1569    1.4279    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.9374    1.8667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5704    2.6480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4329    2.3831    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1333    2.8191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7644    2.2877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4541    1.5233    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6312    1.5823    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.9250    0.9765    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.5474    0.2429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9942    1.7515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3624    2.2415    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0016    3.0723    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6982    2.3149    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.8640    2.5651    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.3717    3.2709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5553    3.0378    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.8320    2.2360    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8216    1.3017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3879    1.8310    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.4176    1.8119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9022    2.4964    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.1515    2.1542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2509    3.0028    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0888    1.3250    0.0000 C   0  0  2  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  6  0  0  0
  7  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
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13  9  1  6  0  0  0
 13 14  1  0  0  0  0
 14 15  1  6  0  0  0
 14 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 19 18  1  6  0  0  0
  8 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  1  0  0  0
 22 21  1  6  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 25 24  1  1  0  0  0
  6 25  1  0  0  0  0
 20 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 22 27  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  1  0  0  0
 30 19  1  1  0  0  0
  5 30  1  0  0  0  0
 14 30  1  0  0  0  0
M  END


  Mrv1652309072207552D          

 30 36  0  0  1  0            999 V2000
    4.0087   -1.4577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1045   -0.6383    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8621   -0.3116    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4428   -0.1456    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5387    0.6738    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.1569    1.4279    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.9374    1.8667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5704    2.6480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4329    2.3831    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1333    2.8191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7644    2.2877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4541    1.5233    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6312    1.5823    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.9250    0.9765    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.5474    0.2429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9942    1.7515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3624    2.2415    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0016    3.0723    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6982    2.3149    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.8640    2.5651    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.3717    3.2709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5553    3.0378    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.8320    2.2360    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8216    1.3017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3879    1.8310    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.4176    1.8119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9022    2.4964    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.1515    2.1542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2509    3.0028    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0888    1.3250    0.0000 C   0  0  2  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  6  0  0  0
  7  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
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13  9  1  6  0  0  0
 13 14  1  0  0  0  0
 14 15  1  6  0  0  0
 14 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 19 18  1  6  0  0  0
  8 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  1  0  0  0
 22 21  1  6  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 25 24  1  1  0  0  0
  6 25  1  0  0  0  0
 20 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 22 27  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  1  0  0  0
 30 19  1  1  0  0  0
  5 30  1  0  0  0  0
 14 30  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0244994

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CC(=O)O[C@H]1[C@H]2OC3N4CCO[C@@H]4[C@]4(C)CCC[C@@]3([C@@H]3C[C@@H]5CC[C@]23C[C@@]5(C)O)[C@H]14

> <INCHI_IDENTIFIER>
InChI=1S/C24H35NO5/c1-13(26)29-16-17-21(2)6-4-7-24(17)15-11-14-5-8-23(15,12-22(14,3)27)18(16)30-20(24)25-9-10-28-19(21)25/h14-20,27H,4-12H2,1-3H3/t14-,15+,16+,17+,18+,19+,20?,21+,22+,23+,24+/m0/s1

> <INCHI_KEY>
ZVGHBOHWOUTHNI-LLVQXVSMSA-N

> <FORMULA>
C24H35NO5

> <MOLECULAR_WEIGHT>
417.546

> <EXACT_MASS>
417.251523231

> <JCHEM_ACCEPTOR_COUNT>
5

> <JCHEM_ATOM_COUNT>
65

> <JCHEM_AVERAGE_POLARIZABILITY>
45.46126998855053

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
(1S,2R,4R,5S,7R,8R,12R,13R,20R,21R)-4-hydroxy-4,12-dimethyl-14,19-dioxa-17-azaheptacyclo[10.7.2.2^{2,5}.0^{2,7}.0^{8,18}.0^{8,21}.0^{13,17}]tricosan-20-yl acetate

> <JCHEM_LOGP>
2.432579756666667

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
7

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_ACIDIC>
14.766815457582222

> <JCHEM_PKA_STRONGEST_BASIC>
5.460585764271164

> <JCHEM_POLAR_SURFACE_AREA>
68.23

> <JCHEM_REFRACTIVITY>
107.84930000000001

> <JCHEM_ROTATABLE_BOND_COUNT>
2

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
(1S,2R,4R,5S,7R,8R,12R,13R,20R,21R)-4-hydroxy-4,12-dimethyl-14,19-dioxa-17-azaheptacyclo[10.7.2.2^{2,5}.0^{2,7}.0^{8,18}.0^{8,21}.0^{13,17}]tricosan-20-yl acetate

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 07-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   07-SEP-22         0                                  
HETATM    1  C   UNK     0       7.483  -2.721   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       7.662  -1.192   0.000  0.00  0.00           C+0
HETATM    3  O   UNK     0       9.076  -0.582   0.000  0.00  0.00           O+0
HETATM    4  O   UNK     0       6.427  -0.272   0.000  0.00  0.00           O+0
HETATM    5  C   UNK     0       6.605   1.258   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       5.893   2.665   0.000  0.00  0.00           C+0
HETATM    7  O   UNK     0       7.350   3.484   0.000  0.00  0.00           O+0
HETATM    8  C   UNK     0       8.531   4.943   0.000  0.00  0.00           C+0
HETATM    9  N   UNK     0      10.141   4.449   0.000  0.00  0.00           N+0
HETATM   10  C   UNK     0      11.449   5.262   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      12.627   4.270   0.000  0.00  0.00           C+0
HETATM   12  O   UNK     0      12.048   2.844   0.000  0.00  0.00           O+0
HETATM   13  C   UNK     0      10.511   2.954   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       9.193   1.823   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       8.489   0.454   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       9.323   3.269   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       8.143   4.184   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       7.470   5.735   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       6.903   4.321   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       5.346   4.788   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       4.427   6.106   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       2.903   5.671   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0       3.420   4.174   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0       3.400   2.430   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0       4.457   3.418   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0       2.646   3.382   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0       1.684   4.660   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0       0.283   4.021   0.000  0.00  0.00           C+0
HETATM   29  O   UNK     0       0.468   5.605   0.000  0.00  0.00           O+0
HETATM   30  C   UNK     0       7.633   2.473   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3    4                                                  
CONECT    3    2                                                            
CONECT    4    2    5                                                       
CONECT    5    4    6   30                                                  
CONECT    6    5    7   25                                                  
CONECT    7    6    8                                                       
CONECT    8    7    9   19                                                  
CONECT    9    8   10   13                                                  
CONECT   10    9   11                                                       
CONECT   11   10   12                                                       
CONECT   12   11   13                                                       
CONECT   13   12    9   14                                                  
CONECT   14   13   15   16   30                                             
CONECT   15   14                                                            
CONECT   16   14   17                                                       
CONECT   17   16   18                                                       
CONECT   18   17   19                                                       
CONECT   19   18    8   20   30                                             
CONECT   20   19   21   25                                                  
CONECT   21   20   22                                                       
CONECT   22   21   23   27                                                  
CONECT   23   22   24                                                       
CONECT   24   23   25                                                       
CONECT   25   24    6   20   26                                             
CONECT   26   25   27                                                       
CONECT   27   26   22   28   29                                             
CONECT   28   27                                                            
CONECT   29   27                                                            
CONECT   30   19    5   14                                                  
MASTER        0    0    0    0    0    0    0    0   30    0   72    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₂₄H₃₅NO₅

Average Mass

417.5460 Da

Monoisotopic Mass

417.25152 Da

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

CC(=O)O[C@H]1[C@H]2OC3N4CCO[C@@H]4[C@]4(C)CCC[C@@]3([C@@H]3C[C@@H]5CC[C@]23C[C@@]5(C)O)[C@H]14

InChI Identifier

InChI=1S/C24H35NO5/c1-13(26)29-16-17-21(2)6-4-7-24(17)15-11-14-5-8-23(15,12-22(14,3)27)18(16)30-20(24)25-9-10-28-19(21)25/h14-20,27H,4-12H2,1-3H3/t14-,15+,16+,17+,18+,19+,20?,21+,22+,23+,24+/m0/s1

InChI Key

ZVGHBOHWOUTHNI-LLVQXVSMSA-N

Experimental Spectra

Not Available

Predicted Spectra

Not Available

Chemical Shift Submissions

Not Available

Species

Species of Origin

Species Name	Source	Reference
Spiraea japonica	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as atisane diterpenoids. These are diterpenoids with a structure based on the atisane skeleton, which is a tetracyclic compound containing the [2,2,2]bicyc1ic ring system with the C15-C16 bridge attached at C12.

Kingdom

Organic compounds

Super Class

Lipids and lipid-like molecules

Class

Prenol lipids

Sub Class

Diterpenoids

Direct Parent

Atisane diterpenoids

Alternative Parents

Substituents

Atisane diterpenoid
Alkaloid or derivatives
Piperidine
Oxane
Tertiary alcohol
Oxazolidine
Cyclic alcohol
Hemiaminal
Carboxylic acid ester
Oxacycle
Azacycle
Organoheterocyclic compound
Monocarboxylic acid or derivatives
Carboxylic acid derivative
Organic nitrogen compound
Organic oxygen compound
Organopnictogen compound
Organic oxide
Hydrocarbon derivative
Organooxygen compound
Organonitrogen compound
Carbonyl group
Alcohol
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

External Links

HMDB ID

Not Available

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FoodDB ID

Not Available

KNApSAcK ID

C00024993

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

101103351

PDB ID

Not Available

ChEBI ID

Not Available

Good Scents ID

Not Available

References

General References

Li L, Shen YM, Yang XS, Wu WL, Wang BG, Chen ZH, Hao XJ: Effects of spiramine T on antioxidant enzymatic activities and nitric oxide production in cerebral ischemia-reperfusion gerbils. Brain Res. 2002 Jul 19;944(1-2):205-9. doi: 10.1016/s0006-8993(02)02892-5. [PubMed:12106682 ]
Li L, Nie J, Shen Z, Wu W, Chen Z, Hao X: Neuroprotective effects in gerbils of spiramine T from Spiraea japonica var. acuta. Planta Med. 2001 Mar;67(2):142-5. doi: 10.1055/s-2001-11510. [PubMed:11301860 ]
LOTUS database [Link]

Showing NP-Card for (1s,2r,4r,5s,7r,8r,12r,13r,20r,21r)-4-hydroxy-4,12-dimethyl-14,19-dioxa-17-azaheptacyclo[10.7.2.2²,⁵.0²,⁷.0⁸,¹⁸.0⁸,²¹.0¹³,¹⁷]tricosan-20-yl acetate (NP0244994)

MOL for NP0244994 ((1s,2r,4r,5s,7r,8r,12r,13r,20r,21r)-4-hydroxy-4,12-dimethyl-14,19-dioxa-17-azaheptacyclo[10.7.2.2²,⁵.0²,⁷.0⁸,¹⁸.0⁸,²¹.0¹³,¹⁷]tricosan-20-yl acetate)

3D MOL for NP0244994 ((1s,2r,4r,5s,7r,8r,12r,13r,20r,21r)-4-hydroxy-4,12-dimethyl-14,19-dioxa-17-azaheptacyclo[10.7.2.2²,⁵.0²,⁷.0⁸,¹⁸.0⁸,²¹.0¹³,¹⁷]tricosan-20-yl acetate)

3D SDF for NP0244994 ((1s,2r,4r,5s,7r,8r,12r,13r,20r,21r)-4-hydroxy-4,12-dimethyl-14,19-dioxa-17-azaheptacyclo[10.7.2.2²,⁵.0²,⁷.0⁸,¹⁸.0⁸,²¹.0¹³,¹⁷]tricosan-20-yl acetate)

3D-SDF for NP0244994 ((1s,2r,4r,5s,7r,8r,12r,13r,20r,21r)-4-hydroxy-4,12-dimethyl-14,19-dioxa-17-azaheptacyclo[10.7.2.2²,⁵.0²,⁷.0⁸,¹⁸.0⁸,²¹.0¹³,¹⁷]tricosan-20-yl acetate)

PDB for NP0244994 ((1s,2r,4r,5s,7r,8r,12r,13r,20r,21r)-4-hydroxy-4,12-dimethyl-14,19-dioxa-17-azaheptacyclo[10.7.2.2²,⁵.0²,⁷.0⁸,¹⁸.0⁸,²¹.0¹³,¹⁷]tricosan-20-yl acetate)

3D PDB for NP0244994 ((1s,2r,4r,5s,7r,8r,12r,13r,20r,21r)-4-hydroxy-4,12-dimethyl-14,19-dioxa-17-azaheptacyclo[10.7.2.2²,⁵.0²,⁷.0⁸,¹⁸.0⁸,²¹.0¹³,¹⁷]tricosan-20-yl acetate)

SMILES for NP0244994 ((1s,2r,4r,5s,7r,8r,12r,13r,20r,21r)-4-hydroxy-4,12-dimethyl-14,19-dioxa-17-azaheptacyclo[10.7.2.2²,⁵.0²,⁷.0⁸,¹⁸.0⁸,²¹.0¹³,¹⁷]tricosan-20-yl acetate)

INCHI for NP0244994 ((1s,2r,4r,5s,7r,8r,12r,13r,20r,21r)-4-hydroxy-4,12-dimethyl-14,19-dioxa-17-azaheptacyclo[10.7.2.2²,⁵.0²,⁷.0⁸,¹⁸.0⁸,²¹.0¹³,¹⁷]tricosan-20-yl acetate)

Structure for NP0244994 ((1s,2r,4r,5s,7r,8r,12r,13r,20r,21r)-4-hydroxy-4,12-dimethyl-14,19-dioxa-17-azaheptacyclo[10.7.2.2²,⁵.0²,⁷.0⁸,¹⁸.0⁸,²¹.0¹³,¹⁷]tricosan-20-yl acetate)

3D Structure for NP0244994 ((1s,2r,4r,5s,7r,8r,12r,13r,20r,21r)-4-hydroxy-4,12-dimethyl-14,19-dioxa-17-azaheptacyclo[10.7.2.2²,⁵.0²,⁷.0⁸,¹⁸.0⁸,²¹.0¹³,¹⁷]tricosan-20-yl acetate)