NP-MRD: Showing NP-Card for (+)-10-Oxonordendrillolide A (NP0352240)

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Record Information

Version

2.0

Created at

2026-02-05 01:50:39 UTC

Updated at

2026-02-05 04:01:47 UTC

NP-MRD ID

NP0352240

Natural Product DOI

https://doi.org/10.57994/5375

Secondary Accession Numbers

None

Natural Product Identification

Common Name

(+)-10-Oxonordendrillolide A

Description

(+)-10-Oxonordendrillolide A was first documented in 2020 (PMID: 31913035).

Structure

MOL SDF PDB SMILES InChI


  Mrv2104 03052323042D          

 32 35  0  0  1  0            999 V2000
   -2.8206    1.2695    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2685    0.6564    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.8560    1.3709    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0491    1.1993    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.4360    1.7514    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6075    2.5583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0056    3.1104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3921    2.8133    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9628    0.3789    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.0060   -0.4450    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7165    0.0433    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.5370   -0.0429    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1290   -0.6712    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9360   -0.4996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5491   -1.0517    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0222    0.3208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2483   -0.0336    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.0872    0.7200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7333   -0.7011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2483   -1.3685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5363   -1.1136    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.2796   -0.7556    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5363   -0.2886    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.3890    0.5232    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1813    0.2258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9977    1.0301    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9856    0.0422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3436   -0.7011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9856   -1.4444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1813   -1.6280    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3829   -2.4280    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6526   -2.2613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  6  0  0  0
  2  3  1  0  0  0  0
  4  3  1  0  0  0  0
  4  5  1  6  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  2  0  0  0  0
  9  4  1  0  0  0  0
  9 10  1  6  0  0  0
  9 11  1  0  0  0  0
 11  2  1  0  0  0  0
 11 12  1  6  0  0  0
 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 14 16  1  0  0  0  0
  2 16  1  0  0  0  0
  9 17  1  1  0  0  0
 17 18  1  6  0  0  0
 17 19  1  0  0  0  0
 19 20  1  0  0  0  0
 21 20  1  0  0  0  0
 21 22  1  1  0  0  0
 23 21  1  0  0  0  0
 17 23  1  1  0  0  0
 23 24  1  1  0  0  0
 23 25  1  0  0  0  0
 25 26  2  0  0  0  0
 25 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 21 30  1  0  0  0  0
 30 31  1  0  0  0  0
 30 32  1  0  0  0  0
M  END


  Mrv2104 03052323042D          

 32 35  0  0  1  0            999 V2000
   -2.8206    1.2695    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2685    0.6564    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.8560    1.3709    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0491    1.1993    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.4360    1.7514    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6075    2.5583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0056    3.1104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3921    2.8133    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9628    0.3789    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.0060   -0.4450    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7165    0.0433    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.5370   -0.0429    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1290   -0.6712    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9360   -0.4996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5491   -1.0517    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0222    0.3208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2483   -0.0336    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.0872    0.7200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7333   -0.7011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2483   -1.3685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5363   -1.1136    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.2796   -0.7556    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5363   -0.2886    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.3890    0.5232    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1813    0.2258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9977    1.0301    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9856    0.0422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3436   -0.7011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9856   -1.4444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1813   -1.6280    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3829   -2.4280    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6526   -2.2613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  6  0  0  0
  2  3  1  0  0  0  0
  4  3  1  0  0  0  0
  4  5  1  6  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  2  0  0  0  0
  9  4  1  0  0  0  0
  9 10  1  6  0  0  0
  9 11  1  0  0  0  0
 11  2  1  0  0  0  0
 11 12  1  6  0  0  0
 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 14 16  1  0  0  0  0
  2 16  1  0  0  0  0
  9 17  1  1  0  0  0
 17 18  1  6  0  0  0
 17 19  1  0  0  0  0
 19 20  1  0  0  0  0
 21 20  1  0  0  0  0
 21 22  1  1  0  0  0
 23 21  1  0  0  0  0
 17 23  1  1  0  0  0
 23 24  1  1  0  0  0
 23 25  1  0  0  0  0
 25 26  2  0  0  0  0
 25 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 21 30  1  0  0  0  0
 30 31  1  0  0  0  0
 30 32  1  0  0  0  0
M  END
> <DATABASE_ID>
NP0352240

> <DATABASE_NAME>
NP-MRD

> <SMILES>
[H][C@]12O[C@H](OC(C)=O)[C@]([H])([C@@]1([H])CC(=O)O2)[C@]1(C)CC[C@]2([H])[C@@]1([H])C(=O)CCCC2(C)C

> <INCHI_IDENTIFIER>
InChI=1S/C21H30O6/c1-11(22)25-19-16(12-10-15(24)26-18(12)27-19)21(4)9-7-13-17(21)14(23)6-5-8-20(13,2)3/h12-13,16-19H,5-10H2,1-4H3/t12-,13-,16+,17+,18+,19+,21+/m1/s1

> <INCHI_KEY>
HGVWJDLUFPTRNZ-MWUORSMFSA-N

> <FORMULA>
C21H30O6

> <MOLECULAR_WEIGHT>
378.465

> <EXACT_MASS>
378.204238686

$$$$

HEADER    PROTEIN                                 05-MAR-23   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   05-MAR-23         0                                  
HETATM    1  H   UNK     0      -5.265   2.370   0.000  0.00  0.00           H+0
HETATM    2  C   UNK     0      -4.235   1.225   0.000  0.00  0.00           C+0
HETATM    3  O   UNK     0      -3.465   2.559   0.000  0.00  0.00           O+0
HETATM    4  C   UNK     0      -1.958   2.239   0.000  0.00  0.00           C+0
HETATM    5  O   UNK     0      -0.814   3.269   0.000  0.00  0.00           O+0
HETATM    6  C   UNK     0      -1.134   4.776   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       0.010   5.806   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0      -2.599   5.251   0.000  0.00  0.00           O+0
HETATM    9  C   UNK     0      -1.797   0.707   0.000  0.00  0.00           C+0
HETATM   10  H   UNK     0      -1.878  -0.831   0.000  0.00  0.00           H+0
HETATM   11  C   UNK     0      -3.204   0.081   0.000  0.00  0.00           C+0
HETATM   12  H   UNK     0      -4.736  -0.080   0.000  0.00  0.00           H+0
HETATM   13  C   UNK     0      -3.974  -1.253   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      -5.480  -0.933   0.000  0.00  0.00           C+0
HETATM   15  O   UNK     0      -6.625  -1.963   0.000  0.00  0.00           O+0
HETATM   16  O   UNK     0      -5.641   0.599   0.000  0.00  0.00           O+0
HETATM   17  C   UNK     0      -0.464  -0.063   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       0.163   1.344   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      -1.369  -1.309   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      -0.464  -2.555   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       1.001  -2.079   0.000  0.00  0.00           C+0
HETATM   22  H   UNK     0       2.389  -1.411   0.000  0.00  0.00           H+0
HETATM   23  C   UNK     0       1.001  -0.539   0.000  0.00  0.00           C+0
HETATM   24  H   UNK     0       0.726   0.977   0.000  0.00  0.00           H+0
HETATM   25  C   UNK     0       2.205   0.421   0.000  0.00  0.00           C+0
HETATM   26  O   UNK     0       1.862   1.923   0.000  0.00  0.00           O+0
HETATM   27  C   UNK     0       3.706   0.079   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0       4.375  -1.309   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0       3.706  -2.696   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0       2.205  -3.039   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0       2.581  -4.532   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0       1.218  -4.221   0.000  0.00  0.00           C+0
CONECT    1    2                                                            
CONECT    2    1    3   11   16                                             
CONECT    3    2    4                                                       
CONECT    4    3    5    9                                                  
CONECT    5    4    6                                                       
CONECT    6    5    7    8                                                  
CONECT    7    6                                                            
CONECT    8    6                                                            
CONECT    9    4   10   11   17                                             
CONECT   10    9                                                            
CONECT   11    9    2   12   13                                             
CONECT   12   11                                                            
CONECT   13   11   14                                                       
CONECT   14   13   15   16                                                  
CONECT   15   14                                                            
CONECT   16   14    2                                                       
CONECT   17    9   18   19   23                                             
CONECT   18   17                                                            
CONECT   19   17   20                                                       
CONECT   20   19   21                                                       
CONECT   21   20   22   23   30                                             
CONECT   22   21                                                            
CONECT   23   21   17   24   25                                             
CONECT   24   23                                                            
CONECT   25   23   26   27                                                  
CONECT   26   25                                                            
CONECT   27   25   28                                                       
CONECT   28   27   29                                                       
CONECT   29   28   30                                                       
CONECT   30   29   21   31   32                                             
CONECT   31   30                                                            
CONECT   32   30                                                            
MASTER        0    0    0    0    0    0    0    0   32    0   70    0
END

View in JSmol

Synonyms

Not Available

Chemical Formula

C₂₁H₃₀O₆

Average Mass

378.4650 Da

Monoisotopic Mass

378.20424 Da

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

[H][C@]12O[C@H](OC(C)=O)[C@]([H])([C@@]1([H])CC(=O)O2)[C@]1(C)CC[C@]2([H])[C@@]1([H])C(=O)CCCC2(C)C

InChI Identifier

InChI=1S/C21H30O6/c1-11(22)25-19-16(12-10-15(24)26-18(12)27-19)21(4)9-7-13-17(21)14(23)6-5-8-20(13,2)3/h12-13,16-19H,5-10H2,1-4H3/t12-,13-,16+,17+,18+,19+,21+/m1/s1

InChI Key

HGVWJDLUFPTRNZ-MWUORSMFSA-N

Experimental Spectra

Spectrum Type	Description	Depositor Email	Depositor Organization	Depositor	Deposition Date	View

Predicted Spectra

Not Available

Chemical Shift Submissions

Spectrum Type	Description	Depositor Email	Depositor Organization	Depositor	Deposition Date	View
1D NMR	¹H NMR Spectrum (1D, 700.0, Chloroform-d, simulated)	epoynton@sfu.ca	Not Available	Not Available	2026-02-05	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 175.0, Chloroform-d, simulated)	epoynton@sfu.ca	Not Available	Not Available	2026-02-05	View Spectrum

Species

Species of Origin

Species Name	Source	Reference
Goniobranchus coi		Not Available

Chemical Taxonomy

Classification

Not classified

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

Not Available

References

General References

Showing NP-Card for (+)-10-Oxonordendrillolide A (NP0352240)

MOL for NP0352240 ((+)-10-Oxonordendrillolide A)

3D MOL for NP0352240 ((+)-10-Oxonordendrillolide A)

3D SDF for NP0352240 ((+)-10-Oxonordendrillolide A)

3D-SDF for NP0352240 ((+)-10-Oxonordendrillolide A)

PDB for NP0352240 ((+)-10-Oxonordendrillolide A)

3D PDB for NP0352240 ((+)-10-Oxonordendrillolide A)

SMILES for NP0352240 ((+)-10-Oxonordendrillolide A)

INCHI for NP0352240 ((+)-10-Oxonordendrillolide A)

Structure for NP0352240 ((+)-10-Oxonordendrillolide A)

3D Structure for NP0352240 ((+)-10-Oxonordendrillolide A)