NP-MRD: Showing NP-Card for (2r,3s)-3-[(1r,3s,7s,8r,10r)-10-hydroxy-2,13-dimethyl-4,11-dioxo-5,9-dioxatetracyclo[6.5.1.0²,¹⁰.0³,⁷]tetradec-12-en-7-yl]-2-methylpentanedioic acid (NP0277200)

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Record Information

Version

2.0

Created at

2022-09-09 01:43:43 UTC

Updated at

2022-09-09 01:43:43 UTC

NP-MRD ID

NP0277200

Secondary Accession Numbers

None

Natural Product Identification

Common Name

(2r,3s)-3-[(1r,3s,7s,8r,10r)-10-hydroxy-2,13-dimethyl-4,11-dioxo-5,9-dioxatetracyclo[6.5.1.0²,¹⁰.0³,⁷]tetradec-12-en-7-yl]-2-methylpentanedioic acid

Description

(2R,3S)-3-[(1R,3S,7S,8R,10R)-10-hydroxy-2,13-dimethyl-4,11-dioxo-5,9-dioxatetracyclo[6.5.1.0²,¹⁰.0³,⁷]Tetradec-12-en-7-yl]-2-methylpentanedioic acid belongs to the class of organic compounds known as terpene lactones. These are prenol lipids containing a lactone ring. (2r,3s)-3-[(1r,3s,7s,8r,10r)-10-hydroxy-2,13-dimethyl-4,11-dioxo-5,9-dioxatetracyclo[6.5.1.0²,¹⁰.0³,⁷]tetradec-12-en-7-yl]-2-methylpentanedioic acid is found in Ailanthus altissima. Based on a literature review very few articles have been published on (2R,3S)-3-[(1R,3S,7S,8R,10R)-10-hydroxy-2,13-dimethyl-4,11-dioxo-5,9-dioxatetracyclo[6.5.1.0²,¹⁰.0³,⁷]Tetradec-12-en-7-yl]-2-methylpentanedioic acid.

Structure

MOL SDF PDB SMILES InChI


  Mrv1652309092203432D          

 29 32  0  0  1  0            999 V2000
   -4.5808   -2.8576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7810   -2.6551    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1241   -3.0464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6041   -2.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3871   -1.9329    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6772   -1.7812    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.3623   -1.3216    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0140   -0.9216    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4196   -0.5045    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.2260   -0.8751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2410   -1.7494    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.2111   -2.1311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1784   -2.9555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3693   -1.7406    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.5657   -1.9273    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2445   -2.6872    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1398   -1.2208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6802   -0.5974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4400   -0.9186    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.4400   -0.0936    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.1545    0.3189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1545    1.1439    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8690    1.5564    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4400    1.5564    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7256    0.3189    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.0111   -0.0936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7256    1.1439    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0611    1.8975    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0111    1.5564    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
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  6  7  1  1  0  0  0
  6  8  1  0  0  0  0
  9  8  1  1  0  0  0
  9 10  1  0  0  0  0
 11 10  1  1  0  0  0
  2 11  1  0  0  0  0
 11 12  1  0  0  0  0
  6 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  1  0  0  0  0
 14 15  1  6  0  0  0
 15 16  2  0  0  0  0
 15 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 14 19  1  0  0  0  0
  9 19  1  0  0  0  0
 19 20  1  1  0  0  0
 20 21  1  1  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 22 24  1  0  0  0  0
 20 25  1  0  0  0  0
 25 26  1  6  0  0  0
 25 27  1  0  0  0  0
 27 28  2  0  0  0  0
 27 29  1  0  0  0  0
M  END


  Mrv1652309092203432D          

 29 32  0  0  1  0            999 V2000
   -4.5808   -2.8576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7810   -2.6551    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1241   -3.0464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6041   -2.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3871   -1.9329    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6772   -1.7812    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.3623   -1.3216    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0140   -0.9216    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4196   -0.5045    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.2260   -0.8751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2410   -1.7494    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.2111   -2.1311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1784   -2.9555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3693   -1.7406    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.5657   -1.9273    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2445   -2.6872    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1398   -1.2208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6802   -0.5974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4400   -0.9186    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.4400   -0.0936    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.1545    0.3189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1545    1.1439    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8690    1.5564    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4400    1.5564    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7256    0.3189    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.0111   -0.0936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7256    1.1439    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0611    1.8975    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0111    1.5564    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
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  6  7  1  1  0  0  0
  6  8  1  0  0  0  0
  9  8  1  1  0  0  0
  9 10  1  0  0  0  0
 11 10  1  1  0  0  0
  2 11  1  0  0  0  0
 11 12  1  0  0  0  0
  6 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  1  0  0  0  0
 14 15  1  6  0  0  0
 15 16  2  0  0  0  0
 15 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 14 19  1  0  0  0  0
  9 19  1  0  0  0  0
 19 20  1  1  0  0  0
 20 21  1  1  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 22 24  1  0  0  0  0
 20 25  1  0  0  0  0
 25 26  1  6  0  0  0
 25 27  1  0  0  0  0
 27 28  2  0  0  0  0
 27 29  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0277200

> <DATABASE_NAME>
NP-MRD

> <SMILES>
C[C@H]([C@H](CC(O)=O)[C@@]12COC(=O)[C@@H]1C1(C)[C@@H]3C[C@H]2O[C@@]1(O)C(=O)C=C3C)C(O)=O

> <INCHI_IDENTIFIER>
InChI=1S/C20H24O9/c1-8-4-12(21)20(27)18(3)10(8)5-13(29-20)19(7-28-17(26)15(18)19)11(6-14(22)23)9(2)16(24)25/h4,9-11,13,15,27H,5-7H2,1-3H3,(H,22,23)(H,24,25)/t9-,10-,11+,13-,15-,18?,19-,20+/m1/s1

> <INCHI_KEY>
DZBLDANEFRTEAG-QCTBMHGUSA-N

> <FORMULA>
C20H24O9

> <MOLECULAR_WEIGHT>
408.403

> <EXACT_MASS>
408.142032353

> <JCHEM_ACCEPTOR_COUNT>
8

> <JCHEM_ATOM_COUNT>
53

> <JCHEM_AVERAGE_POLARIZABILITY>
38.55973604624801

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
3

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
(2R,3S)-3-[(1R,3S,7S,8R,10R)-10-hydroxy-2,13-dimethyl-4,11-dioxo-5,9-dioxatetracyclo[6.5.1.0^{2,10}.0^{3,7}]tetradec-12-en-7-yl]-2-methylpentanedioic acid

> <JCHEM_LOGP>
0.9238535240000002

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
4

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-2

> <JCHEM_PKA>
4.354466132592935

> <JCHEM_PKA_STRONGEST_ACIDIC>
3.694263687297364

> <JCHEM_PKA_STRONGEST_BASIC>
-4.401601839577161

> <JCHEM_POLAR_SURFACE_AREA>
147.43

> <JCHEM_REFRACTIVITY>
95.28379999999999

> <JCHEM_ROTATABLE_BOND_COUNT>
5

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
(2R,3S)-3-[(1R,3S,7S,8R,10R)-10-hydroxy-2,13-dimethyl-4,11-dioxo-5,9-dioxatetracyclo[6.5.1.0^{2,10}.0^{3,7}]tetradec-12-en-7-yl]-2-methylpentanedioic acid

> <JCHEM_VEBER_RULE>
0

$$$$

HEADER    PROTEIN                                 09-SEP-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   09-SEP-22         0                                  
HETATM    1  C   UNK     0      -8.551  -5.334   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -7.058  -4.956   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -5.832  -5.687   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -6.728  -4.093   0.000  0.00  0.00           C+0
HETATM    5  O   UNK     0      -8.189  -3.608   0.000  0.00  0.00           O+0
HETATM    6  C   UNK     0      -4.998  -3.325   0.000  0.00  0.00           C+0
HETATM    7  O   UNK     0      -6.276  -2.467   0.000  0.00  0.00           O+0
HETATM    8  O   UNK     0      -3.759  -1.720   0.000  0.00  0.00           O+0
HETATM    9  C   UNK     0      -4.517  -0.942   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      -6.022  -1.633   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -6.050  -3.266   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      -4.127  -3.978   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      -4.066  -5.517   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      -2.556  -3.249   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      -1.056  -3.598   0.000  0.00  0.00           C+0
HETATM   16  O   UNK     0      -0.456  -5.016   0.000  0.00  0.00           O+0
HETATM   17  O   UNK     0      -0.261  -2.279   0.000  0.00  0.00           O+0
HETATM   18  C   UNK     0      -1.270  -1.115   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      -2.688  -1.715   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      -2.688  -0.175   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      -4.022   0.595   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      -4.022   2.135   0.000  0.00  0.00           C+0
HETATM   23  O   UNK     0      -5.355   2.905   0.000  0.00  0.00           O+0
HETATM   24  O   UNK     0      -2.688   2.905   0.000  0.00  0.00           O+0
HETATM   25  C   UNK     0      -1.354   0.595   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0      -0.021  -0.175   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0      -1.354   2.135   0.000  0.00  0.00           C+0
HETATM   28  O   UNK     0      -1.981   3.542   0.000  0.00  0.00           O+0
HETATM   29  O   UNK     0      -0.021   2.905   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3   11                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5    6                                                  
CONECT    5    4                                                            
CONECT    6    4    7    8   12                                             
CONECT    7    6                                                            
CONECT    8    6    9                                                       
CONECT    9    8   10   19                                                  
CONECT   10    9   11                                                       
CONECT   11   10    2   12                                                  
CONECT   12   11    6   13   14                                             
CONECT   13   12                                                            
CONECT   14   12   15   19                                                  
CONECT   15   14   16   17                                                  
CONECT   16   15                                                            
CONECT   17   15   18                                                       
CONECT   18   17   19                                                       
CONECT   19   18   14    9   20                                             
CONECT   20   19   21   25                                                  
CONECT   21   20   22                                                       
CONECT   22   21   23   24                                                  
CONECT   23   22                                                            
CONECT   24   22                                                            
CONECT   25   20   26   27                                                  
CONECT   26   25                                                            
CONECT   27   25   28   29                                                  
CONECT   28   27                                                            
CONECT   29   27                                                            
MASTER        0    0    0    0    0    0    0    0   29    0   64    0
END

View in JSmol

Synonyms

Value	Source
(2R,3S)-3-[(1R,3S,7S,8R,10R)-10-Hydroxy-2,13-dimethyl-4,11-dioxo-5,9-dioxatetracyclo[6.5.1.0,.0,]tetradec-12-en-7-yl]-2-methylpentanedioate	Generator

Chemical Formula

C₂₀H₂₄O₉

Average Mass

408.4030 Da

Monoisotopic Mass

408.14203 Da

IUPAC Name

(2R,3S)-3-[(1R,3S,7S,8R,10R)-10-hydroxy-2,13-dimethyl-4,11-dioxo-5,9-dioxatetracyclo[6.5.1.0^{2,10}.0^{3,7}]tetradec-12-en-7-yl]-2-methylpentanedioic acid

Traditional Name

(2R,3S)-3-[(1R,3S,7S,8R,10R)-10-hydroxy-2,13-dimethyl-4,11-dioxo-5,9-dioxatetracyclo[6.5.1.0^{2,10}.0^{3,7}]tetradec-12-en-7-yl]-2-methylpentanedioic acid

CAS Registry Number

Not Available

SMILES

C[C@H]([C@H](CC(O)=O)[C@@]12COC(=O)[C@@H]1C1(C)[C@@H]3C[C@H]2O[C@@]1(O)C(=O)C=C3C)C(O)=O

InChI Identifier

InChI=1S/C20H24O9/c1-8-4-12(21)20(27)18(3)10(8)5-13(29-20)19(7-28-17(26)15(18)19)11(6-14(22)23)9(2)16(24)25/h4,9-11,13,15,27H,5-7H2,1-3H3,(H,22,23)(H,24,25)/t9-,10-,11+,13-,15-,18?,19-,20+/m1/s1

InChI Key

DZBLDANEFRTEAG-QCTBMHGUSA-N

Experimental Spectra

Not Available

Predicted Spectra

Not Available

Chemical Shift Submissions

Not Available

Species

Species of Origin

Species Name	Source	Reference
Ailanthus altissima	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as terpene lactones. These are prenol lipids containing a lactone ring.

Kingdom

Organic compounds

Super Class

Lipids and lipid-like molecules

Class

Prenol lipids

Sub Class

Terpene lactones

Direct Parent

Terpene lactones

Alternative Parents

Substituents

Terpene lactone
Sesquiterpenoid
Tricarboxylic acid or derivatives
Furopyran
Carbocyclic fatty acid
Cyclohexenone
Hydroxy fatty acid
Fatty acyl
Pyran
Oxane
Gamma butyrolactone
Tetrahydrofuran
Furan
Lactone
Ketone
Hemiacetal
Carboxylic acid ester
Oxacycle
Organoheterocyclic compound
Carboxylic acid
Carboxylic acid derivative
Organic oxygen compound
Organic oxide
Hydrocarbon derivative
Organooxygen compound
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	0.92	ChemAxon
pKa (Strongest Acidic)	3.69	ChemAxon
pKa (Strongest Basic)	-4.4	ChemAxon
Physiological Charge	-2	ChemAxon
Hydrogen Acceptor Count	8	ChemAxon
Hydrogen Donor Count	3	ChemAxon
Polar Surface Area	147.43 Å²	ChemAxon
Rotatable Bond Count	5	ChemAxon
Refractivity	95.28 m³·mol⁻¹	ChemAxon
Polarizability	38.56 Å³	ChemAxon
Number of Rings	4	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

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PubChem Compound

163188000

PDB ID

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ChEBI ID

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Good Scents ID

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References

General References

LOTUS database [Link]

Showing NP-Card for (2r,3s)-3-[(1r,3s,7s,8r,10r)-10-hydroxy-2,13-dimethyl-4,11-dioxo-5,9-dioxatetracyclo[6.5.1.0²,¹⁰.0³,⁷]tetradec-12-en-7-yl]-2-methylpentanedioic acid (NP0277200)

MOL for NP0277200 ((2r,3s)-3-[(1r,3s,7s,8r,10r)-10-hydroxy-2,13-dimethyl-4,11-dioxo-5,9-dioxatetracyclo[6.5.1.0²,¹⁰.0³,⁷]tetradec-12-en-7-yl]-2-methylpentanedioic acid)

3D MOL for NP0277200 ((2r,3s)-3-[(1r,3s,7s,8r,10r)-10-hydroxy-2,13-dimethyl-4,11-dioxo-5,9-dioxatetracyclo[6.5.1.0²,¹⁰.0³,⁷]tetradec-12-en-7-yl]-2-methylpentanedioic acid)

3D SDF for NP0277200 ((2r,3s)-3-[(1r,3s,7s,8r,10r)-10-hydroxy-2,13-dimethyl-4,11-dioxo-5,9-dioxatetracyclo[6.5.1.0²,¹⁰.0³,⁷]tetradec-12-en-7-yl]-2-methylpentanedioic acid)

3D-SDF for NP0277200 ((2r,3s)-3-[(1r,3s,7s,8r,10r)-10-hydroxy-2,13-dimethyl-4,11-dioxo-5,9-dioxatetracyclo[6.5.1.0²,¹⁰.0³,⁷]tetradec-12-en-7-yl]-2-methylpentanedioic acid)

PDB for NP0277200 ((2r,3s)-3-[(1r,3s,7s,8r,10r)-10-hydroxy-2,13-dimethyl-4,11-dioxo-5,9-dioxatetracyclo[6.5.1.0²,¹⁰.0³,⁷]tetradec-12-en-7-yl]-2-methylpentanedioic acid)

3D PDB for NP0277200 ((2r,3s)-3-[(1r,3s,7s,8r,10r)-10-hydroxy-2,13-dimethyl-4,11-dioxo-5,9-dioxatetracyclo[6.5.1.0²,¹⁰.0³,⁷]tetradec-12-en-7-yl]-2-methylpentanedioic acid)

SMILES for NP0277200 ((2r,3s)-3-[(1r,3s,7s,8r,10r)-10-hydroxy-2,13-dimethyl-4,11-dioxo-5,9-dioxatetracyclo[6.5.1.0²,¹⁰.0³,⁷]tetradec-12-en-7-yl]-2-methylpentanedioic acid)

INCHI for NP0277200 ((2r,3s)-3-[(1r,3s,7s,8r,10r)-10-hydroxy-2,13-dimethyl-4,11-dioxo-5,9-dioxatetracyclo[6.5.1.0²,¹⁰.0³,⁷]tetradec-12-en-7-yl]-2-methylpentanedioic acid)

Structure for NP0277200 ((2r,3s)-3-[(1r,3s,7s,8r,10r)-10-hydroxy-2,13-dimethyl-4,11-dioxo-5,9-dioxatetracyclo[6.5.1.0²,¹⁰.0³,⁷]tetradec-12-en-7-yl]-2-methylpentanedioic acid)

3D Structure for NP0277200 ((2r,3s)-3-[(1r,3s,7s,8r,10r)-10-hydroxy-2,13-dimethyl-4,11-dioxo-5,9-dioxatetracyclo[6.5.1.0²,¹⁰.0³,⁷]tetradec-12-en-7-yl]-2-methylpentanedioic acid)