NP-MRD: Showing NP-Card for (1s,13r,15r,16s,18r,19r)-9,15-dimethoxy-5,7,17-trioxa-12-azahexacyclo[10.6.2.0¹,¹³.0²,¹⁰.0⁴,⁸.0¹⁶,¹⁸]icosa-2,4(8),9-trien-19-yl acetate (NP0320913)

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Record Information

Version

2.0

Created at

2022-09-11 22:49:42 UTC

Updated at

2022-09-11 22:49:42 UTC

NP-MRD ID

NP0320913

Secondary Accession Numbers

None

Natural Product Identification

Common Name

(1s,13r,15r,16s,18r,19r)-9,15-dimethoxy-5,7,17-trioxa-12-azahexacyclo[10.6.2.0¹,¹³.0²,¹⁰.0⁴,⁸.0¹⁶,¹⁸]icosa-2,4(8),9-trien-19-yl acetate

Description

(1S,13R,15R,16S,18R,19R)-9,15-dimethoxy-5,7,17-trioxa-12-azahexacyclo[10.6.2.0¹,¹³.0²,¹⁰.0⁴,⁸.0¹⁶,¹⁸]Icosa-2,4(8),9-trien-19-yl acetate belongs to the class of organic compounds known as crinine- and haemanthamine-type amaryllidaceae alkaloids. These are amaryllidaceae alkaloids compounds with a structure based on the crinine or haemanthamine backbone. Both backbones have a common 5,10b-ethano bridge moiety in their frameworks, which is a very significant taxonomic feature, and the configurations of the 5,10b-ethano bridge are opposite to each other. (1s,13r,15r,16s,18r,19r)-9,15-dimethoxy-5,7,17-trioxa-12-azahexacyclo[10.6.2.0¹,¹³.0²,¹⁰.0⁴,⁸.0¹⁶,¹⁸]icosa-2,4(8),9-trien-19-yl acetate is found in Ammocharis tinneana. Based on a literature review very few articles have been published on (1S,13R,15R,16S,18R,19R)-9,15-dimethoxy-5,7,17-trioxa-12-azahexacyclo[10.6.2.0¹,¹³.0²,¹⁰.0⁴,⁸.0¹⁶,¹⁸]Icosa-2,4(8),9-trien-19-yl acetate.

Structure

MOL SDF PDB SMILES InChI


  Mrv1652309122200492D          

 28 33  0  0  1  0            999 V2000
    7.2850   -2.7197    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4589   -2.5256    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8889   -1.8652    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0641   -1.8845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6350   -1.1799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0307   -0.4560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8555   -0.4367    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2846   -1.1413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0873   -0.9510    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1544   -0.1287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3931    0.1891    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8166   -1.0760    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.2251   -1.6511    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.3707   -1.2664    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7662   -0.5647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9557   -0.7185    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0382    0.2142    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3059   -2.4721    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9983   -2.9208    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.7807   -2.6593    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6959   -1.8921    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.9288   -2.1957    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2823   -1.6831    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.5057   -2.2114    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9679   -2.8761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4030   -0.8670    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.5237   -0.0508    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1701   -0.5634    0.0000 C   0  0  2  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  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  3  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
  7 11  1  0  0  0  0
 12  5  1  6  0  0  0
 12 13  1  0  0  0  0
 13 14  1  6  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  2  0  0  0  0
 13 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
  4 20  1  0  0  0  0
 21 19  1  6  0  0  0
 12 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  1  0  0  0
 24 25  1  0  0  0  0
 23 26  1  0  0  0  0
 26 27  1  6  0  0  0
 28 27  1  6  0  0  0
 26 28  1  0  0  0  0
 12 28  1  0  0  0  0
M  END


  Mrv1652309122200492D          

 28 33  0  0  1  0            999 V2000
    7.2850   -2.7197    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4589   -2.5256    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8889   -1.8652    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0641   -1.8845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6350   -1.1799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0307   -0.4560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8555   -0.4367    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2846   -1.1413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0873   -0.9510    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1544   -0.1287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3931    0.1891    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8166   -1.0760    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.2251   -1.6511    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.3707   -1.2664    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7662   -0.5647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9557   -0.7185    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0382    0.2142    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3059   -2.4721    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9983   -2.9208    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.7807   -2.6593    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6959   -1.8921    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.9288   -2.1957    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2823   -1.6831    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.5057   -2.2114    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9679   -2.8761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4030   -0.8670    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.5237   -0.0508    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1701   -0.5634    0.0000 C   0  0  2  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  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  3  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
  7 11  1  0  0  0  0
 12  5  1  6  0  0  0
 12 13  1  0  0  0  0
 13 14  1  6  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  2  0  0  0  0
 13 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
  4 20  1  0  0  0  0
 21 19  1  6  0  0  0
 12 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  1  0  0  0
 24 25  1  0  0  0  0
 23 26  1  0  0  0  0
 26 27  1  6  0  0  0
 28 27  1  6  0  0  0
 26 28  1  0  0  0  0
 12 28  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0320913

> <DATABASE_NAME>
NP-MRD

> <SMILES>
CO[C@@H]1C[C@H]2N3C[C@H](OC(C)=O)[C@]2([C@H]2O[C@@H]12)C1=CC2=C(OCO2)C(OC)=C1C3

> <INCHI_IDENTIFIER>
InChI=1S/C20H23NO7/c1-9(22)27-15-7-21-6-10-11(4-13-17(16(10)24-3)26-8-25-13)20(15)14(21)5-12(23-2)18-19(20)28-18/h4,12,14-15,18-19H,5-8H2,1-3H3/t12-,14-,15+,18+,19+,20+/m1/s1

> <INCHI_KEY>
HUKHZLUIPVCSIS-KKDMEDJGSA-N

> <FORMULA>
C20H23NO7

> <MOLECULAR_WEIGHT>
389.404

> <EXACT_MASS>
389.147452085

> <JCHEM_ACCEPTOR_COUNT>
7

> <JCHEM_ATOM_COUNT>
51

> <JCHEM_AVERAGE_POLARIZABILITY>
39.603017017212196

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
(1S,13R,15R,16S,18R,19R)-9,15-dimethoxy-5,7,17-trioxa-12-azahexacyclo[10.6.2.0^{1,13}.0^{2,10}.0^{4,8}.0^{16,18}]icosa-2,4(8),9-trien-19-yl acetate

> <JCHEM_LOGP>
0.4830213190000002

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
6

> <JCHEM_PHYSIOLOGICAL_CHARGE>
1

> <JCHEM_PKA_STRONGEST_BASIC>
7.687354003864678

> <JCHEM_POLAR_SURFACE_AREA>
78.99000000000001

> <JCHEM_REFRACTIVITY>
94.81509999999997

> <JCHEM_ROTATABLE_BOND_COUNT>
4

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
(1S,13R,15R,16S,18R,19R)-9,15-dimethoxy-5,7,17-trioxa-12-azahexacyclo[10.6.2.0^{1,13}.0^{2,10}.0^{4,8}.0^{16,18}]icosa-2,4(8),9-trien-19-yl acetate

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 12-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   12-SEP-22         0                                  
HETATM    1  C   UNK     0      13.599  -5.077   0.000  0.00  0.00           C+0
HETATM    2  O   UNK     0      12.057  -4.714   0.000  0.00  0.00           O+0
HETATM    3  C   UNK     0      10.993  -3.482   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       9.453  -3.518   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       8.652  -2.202   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       9.391  -0.851   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      10.930  -0.815   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      11.731  -2.130   0.000  0.00  0.00           C+0
HETATM    9  O   UNK     0      13.230  -1.775   0.000  0.00  0.00           O+0
HETATM   10  C   UNK     0      13.355  -0.240   0.000  0.00  0.00           C+0
HETATM   11  O   UNK     0      11.934   0.353   0.000  0.00  0.00           O+0
HETATM   12  C   UNK     0       7.124  -2.009   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       6.020  -3.082   0.000  0.00  0.00           C+0
HETATM   14  O   UNK     0       4.425  -2.364   0.000  0.00  0.00           O+0
HETATM   15  C   UNK     0       3.297  -1.054   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       1.784  -1.341   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0       3.805   0.400   0.000  0.00  0.00           O+0
HETATM   18  C   UNK     0       6.171  -4.615   0.000  0.00  0.00           C+0
HETATM   19  N   UNK     0       7.463  -5.452   0.000  0.00  0.00           N+0
HETATM   20  C   UNK     0       8.924  -4.964   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       6.899  -3.532   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       5.467  -4.099   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0       4.260  -3.142   0.000  0.00  0.00           C+0
HETATM   24  O   UNK     0       2.811  -4.128   0.000  0.00  0.00           O+0
HETATM   25  C   UNK     0       1.807  -5.369   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0       4.486  -1.618   0.000  0.00  0.00           C+0
HETATM   27  O   UNK     0       4.711  -0.095   0.000  0.00  0.00           O+0
HETATM   28  C   UNK     0       5.918  -1.052   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3                                                       
CONECT    3    2    4    8                                                  
CONECT    4    3    5   20                                                  
CONECT    5    4    6   12                                                  
CONECT    6    5    7                                                       
CONECT    7    6    8   11                                                  
CONECT    8    7    3    9                                                  
CONECT    9    8   10                                                       
CONECT   10    9   11                                                       
CONECT   11   10    7                                                       
CONECT   12    5   13   21   28                                             
CONECT   13   12   14   18                                                  
CONECT   14   13   15                                                       
CONECT   15   14   16   17                                                  
CONECT   16   15                                                            
CONECT   17   15                                                            
CONECT   18   13   19                                                       
CONECT   19   18   20   21                                                  
CONECT   20   19    4                                                       
CONECT   21   19   12   22                                                  
CONECT   22   21   23                                                       
CONECT   23   22   24   26                                                  
CONECT   24   23   25                                                       
CONECT   25   24                                                            
CONECT   26   23   27   28                                                  
CONECT   27   26   28                                                       
CONECT   28   27   26   12                                                  
MASTER        0    0    0    0    0    0    0    0   28    0   66    0
END

View in JSmol

Synonyms

Value	Source
(1S,13R,15R,16S,18R,19R)-9,15-Dimethoxy-5,7,17-trioxa-12-azahexacyclo[10.6.2.0,.0,.0,.0,]icosa-2,4(8),9-trien-19-yl acetic acid	Generator

Chemical Formula

C₂₀H₂₃NO₇

Average Mass

389.4040 Da

Monoisotopic Mass

389.14745 Da

IUPAC Name

(1S,13R,15R,16S,18R,19R)-9,15-dimethoxy-5,7,17-trioxa-12-azahexacyclo[10.6.2.0^{1,13}.0^{2,10}.0^{4,8}.0^{16,18}]icosa-2,4(8),9-trien-19-yl acetate

Traditional Name

(1S,13R,15R,16S,18R,19R)-9,15-dimethoxy-5,7,17-trioxa-12-azahexacyclo[10.6.2.0^{1,13}.0^{2,10}.0^{4,8}.0^{16,18}]icosa-2,4(8),9-trien-19-yl acetate

CAS Registry Number

Not Available

SMILES

CO[C@@H]1C[C@H]2N3C[C@H](OC(C)=O)[C@]2([C@H]2O[C@@H]12)C1=CC2=C(OCO2)C(OC)=C1C3

InChI Identifier

InChI=1S/C20H23NO7/c1-9(22)27-15-7-21-6-10-11(4-13-17(16(10)24-3)26-8-25-13)20(15)14(21)5-12(23-2)18-19(20)28-18/h4,12,14-15,18-19H,5-8H2,1-3H3/t12-,14-,15+,18+,19+,20+/m1/s1

InChI Key

HUKHZLUIPVCSIS-KKDMEDJGSA-N

Experimental Spectra

Not Available

Predicted Spectra

Not Available

Chemical Shift Submissions

Not Available

Species

Species of Origin

Species Name	Source	Reference
Ammocharis tinneana	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as crinine- and haemanthamine-type amaryllidaceae alkaloids. These are amaryllidaceae alkaloids compounds with a structure based on the crinine or haemanthamine backbone. Both backbones have a common 5,10b-ethano bridge moiety in their frameworks, which is a very significant taxonomic feature, and the configurations of the 5,10b-ethano bridge are opposite to each other.

Kingdom

Organic compounds

Super Class

Alkaloids and derivatives

Class

Amaryllidaceae alkaloids

Sub Class

Crinine- and Haemanthamine-type amaryllidaceae alkaloids

Direct Parent

Crinine- and Haemanthamine-type amaryllidaceae alkaloids

Alternative Parents

Substituents

Hemanthamine/crinine alkaloid skeleton
Benzoquinoline
Phenanthridine
Benzazepine
Quinoline
Tetrahydroisoquinoline
Benzodioxole
Indole or derivatives
Anisole
Alkyl aryl ether
Azepine
Aralkylamine
Oxepane
Benzenoid
N-alkylpyrrolidine
Pyrrolidine
Tertiary aliphatic amine
Tertiary amine
Amino acid or derivatives
Carboxylic acid ester
Acetal
Organoheterocyclic compound
Monocarboxylic acid or derivatives
Azacycle
Ether
Oxirane
Dialkyl ether
Carboxylic acid derivative
Oxacycle
Organic nitrogen compound
Carbonyl group
Hydrocarbon derivative
Organic oxide
Organopnictogen compound
Organic oxygen compound
Organonitrogen compound
Amine
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
logP	0.48	ChemAxon
pKa (Strongest Basic)	7.69	ChemAxon
Physiological Charge	1	ChemAxon
Hydrogen Acceptor Count	7	ChemAxon
Hydrogen Donor Count	0	ChemAxon
Polar Surface Area	78.99 Å²	ChemAxon
Rotatable Bond Count	4	ChemAxon
Refractivity	94.82 m³·mol⁻¹	ChemAxon
Polarizability	39.6 Å³	ChemAxon
Number of Rings	6	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	Yes	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

162845168

PDB ID

Not Available

ChEBI ID

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Good Scents ID

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References

General References

LOTUS database [Link]

Showing NP-Card for (1s,13r,15r,16s,18r,19r)-9,15-dimethoxy-5,7,17-trioxa-12-azahexacyclo[10.6.2.0¹,¹³.0²,¹⁰.0⁴,⁸.0¹⁶,¹⁸]icosa-2,4(8),9-trien-19-yl acetate (NP0320913)

MOL for NP0320913 ((1s,13r,15r,16s,18r,19r)-9,15-dimethoxy-5,7,17-trioxa-12-azahexacyclo[10.6.2.0¹,¹³.0²,¹⁰.0⁴,⁸.0¹⁶,¹⁸]icosa-2,4(8),9-trien-19-yl acetate)

3D MOL for NP0320913 ((1s,13r,15r,16s,18r,19r)-9,15-dimethoxy-5,7,17-trioxa-12-azahexacyclo[10.6.2.0¹,¹³.0²,¹⁰.0⁴,⁸.0¹⁶,¹⁸]icosa-2,4(8),9-trien-19-yl acetate)

3D SDF for NP0320913 ((1s,13r,15r,16s,18r,19r)-9,15-dimethoxy-5,7,17-trioxa-12-azahexacyclo[10.6.2.0¹,¹³.0²,¹⁰.0⁴,⁸.0¹⁶,¹⁸]icosa-2,4(8),9-trien-19-yl acetate)

3D-SDF for NP0320913 ((1s,13r,15r,16s,18r,19r)-9,15-dimethoxy-5,7,17-trioxa-12-azahexacyclo[10.6.2.0¹,¹³.0²,¹⁰.0⁴,⁸.0¹⁶,¹⁸]icosa-2,4(8),9-trien-19-yl acetate)

PDB for NP0320913 ((1s,13r,15r,16s,18r,19r)-9,15-dimethoxy-5,7,17-trioxa-12-azahexacyclo[10.6.2.0¹,¹³.0²,¹⁰.0⁴,⁸.0¹⁶,¹⁸]icosa-2,4(8),9-trien-19-yl acetate)

3D PDB for NP0320913 ((1s,13r,15r,16s,18r,19r)-9,15-dimethoxy-5,7,17-trioxa-12-azahexacyclo[10.6.2.0¹,¹³.0²,¹⁰.0⁴,⁸.0¹⁶,¹⁸]icosa-2,4(8),9-trien-19-yl acetate)

SMILES for NP0320913 ((1s,13r,15r,16s,18r,19r)-9,15-dimethoxy-5,7,17-trioxa-12-azahexacyclo[10.6.2.0¹,¹³.0²,¹⁰.0⁴,⁸.0¹⁶,¹⁸]icosa-2,4(8),9-trien-19-yl acetate)

INCHI for NP0320913 ((1s,13r,15r,16s,18r,19r)-9,15-dimethoxy-5,7,17-trioxa-12-azahexacyclo[10.6.2.0¹,¹³.0²,¹⁰.0⁴,⁸.0¹⁶,¹⁸]icosa-2,4(8),9-trien-19-yl acetate)

Structure for NP0320913 ((1s,13r,15r,16s,18r,19r)-9,15-dimethoxy-5,7,17-trioxa-12-azahexacyclo[10.6.2.0¹,¹³.0²,¹⁰.0⁴,⁸.0¹⁶,¹⁸]icosa-2,4(8),9-trien-19-yl acetate)

3D Structure for NP0320913 ((1s,13r,15r,16s,18r,19r)-9,15-dimethoxy-5,7,17-trioxa-12-azahexacyclo[10.6.2.0¹,¹³.0²,¹⁰.0⁴,⁸.0¹⁶,¹⁸]icosa-2,4(8),9-trien-19-yl acetate)