NP-MRD: Showing NP-Card for (+)-Alantolactone (NP0059360)

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Record Information

Version

2.0

Created at

2022-04-28 04:37:06 UTC

Updated at

2022-04-28 04:37:06 UTC

NP-MRD ID

NP0059360

Secondary Accession Numbers

None

Natural Product Identification

Common Name

(+)-Alantolactone

Description

Alantolactone, also known as helenine or alant camphor, belongs to the class of organic compounds known as eudesmanolides, secoeudesmanolides, and derivatives. These are terpenoids with a structure based on the eudesmanolide (a 3,5a,9-trimethyl-naphtho[1,2-b]furan-2-one derivative) or secoeudesmanolide (a 3,6-dimethyl-5-(pentan-2-yl)-1-benzofuran-2-one derivative) skeleton. Thus, alantolactone is considered to be an isoprenoid. (+)-Alantolactone is found in Abutilon indicum , Ajania fruticulosa , Artemisia maritima, Bidens subalternans, Chrysanthemum morifolium, Eupatorium cannabinum, Geigeria brevifolia, Inula caspica, Inula grandis, Inula helenium , Inula japonica, Inula magnifica, Inula racemosa , Inula royleana, Inula salicina , Kerria japonica, Klasea latifolia, Saussurea lappa , Tagetes patula , Tanacetum parthenium and Telekia speciosa. (+)-Alantolactone was first documented in 2022 (PMID: 35464223). Based on a literature review a small amount of articles have been published on alantolactone (PMID: 35469529) (PMID: 35370661) (PMID: 35290888) (PMID: 35281907).

Structure

MOL 3D MOL SDF PDB SMILES InChI

     RDKit          3D

 37 39  0  0  0  0  0  0  0  0999 V2000
    3.0543    2.6395    0.7115 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5907    1.4006    0.7713 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1890    0.2133    0.1778 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2016    0.2255   -0.5932 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4584   -0.8850    0.6084 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5996   -0.5255    1.6410 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.2661   -1.2411    1.6142 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3850   -1.1084    0.2386 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.5237   -1.8272   -0.7260 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6688   -1.8963    0.3084 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8379   -1.1333   -0.2731 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4114   -0.3219   -1.4795 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6456    0.8537   -0.9367 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.0929    1.7510   -1.9974 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5748    0.3141   -0.0338 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2263    1.2039    0.5333 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3513    0.9313    1.4579 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.5295    3.4538    1.1901 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9519    2.8678    0.1937 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0368   -0.7084    2.6422 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3574   -2.2940    1.9305 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3980   -0.6973    2.3271 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1187   -2.6128   -0.1706 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1430   -1.1730   -1.3370 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0755   -2.4530   -1.4524 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9512   -2.1569    1.3495 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6121   -2.8581   -0.2429 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6405   -1.8510   -0.5134 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1993   -0.4490    0.5244 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3325    0.0161   -2.0087 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7766   -0.9522   -2.1517 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3696    1.4540   -0.3313 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8666    1.9060   -2.7644 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9018    2.7470   -1.5263 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1171    1.4202   -2.4071 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0478    2.2753    0.2999 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2111    1.4714    2.4258 H   0  0  0  0  0  0  0  0  0  0  0  0
 14 13  1  0
 13 12  1  0
 12 11  1  0
 11 10  1  0
 10  8  1  0
  8  9  1  6
  8  7  1  0
  7  6  1  0
  6  5  1  0
  5  3  1  0
  3  4  2  0
  3  2  1  0
  2  1  2  3
  2 17  1  0
 17 16  1  0
 16 15  2  0
 15 13  1  0
 15  8  1  0
 17  6  1  0
 14 33  1  0
 14 34  1  0
 14 35  1  0
 13 32  1  1
 12 30  1  0
 12 31  1  0
 11 28  1  0
 11 29  1  0
 10 26  1  0
 10 27  1  0
  9 23  1  0
  9 24  1  0
  9 25  1  0
  7 21  1  0
  7 22  1  0
  6 20  1  1
  1 18  1  0
  1 19  1  0
 17 37  1  1
 16 36  1  0
M  END


  Mrv1652304282206372D          

 17 19  0  0  1  0            999 V2000
    1.4289    0.0000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.1434   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -0.4125    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.5724   -1.2375    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.8579   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -1.2375    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.4289   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3570   -1.4924    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8419   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6669   -0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3570   -0.1576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6119    0.6271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.8250    0.0000 C   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  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  2  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  1 10  1  0  0  0  0
  7 11  1  6  0  0  0
  5 12  1  6  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
  4 15  1  6  0  0  0
 15 16  2  0  0  0  0
  1 17  1  6  0  0  0
M  END
> <DATABASE_ID>
NP0059360

> <DATABASE_NAME>
NP-MRD

> <SMILES>
C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)C(=C)[C@H]3C=C12

> <INCHI_IDENTIFIER>
InChI=1S/C15H20O2/c1-9-5-4-6-15(3)8-13-11(7-12(9)15)10(2)14(16)17-13/h7,9,11,13H,2,4-6,8H2,1,3H3/t9-,11+,13+,15+/m0/s1

> <INCHI_KEY>
PXOYOCNNSUAQNS-AGNJHWRGSA-N

> <FORMULA>
C15H20O2

> <MOLECULAR_WEIGHT>
232.323

> <EXACT_MASS>
232.146329884

> <JCHEM_ACCEPTOR_COUNT>
1

> <JCHEM_ATOM_COUNT>
37

> <JCHEM_AVERAGE_POLARIZABILITY>
26.153244918932003

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
(3aR,5S,8aR,9aR)-5,8a-dimethyl-3-methylidene-2H,3H,3aH,5H,6H,7H,8H,8aH,9H,9aH-naphtho[2,3-b]furan-2-one

> <ALOGPS_LOGP>
4.13

> <JCHEM_LOGP>
3.3000416516666675

> <ALOGPS_LOGS>
-3.66

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_BASIC>
-6.875766859959126

> <JCHEM_POLAR_SURFACE_AREA>
26.3

> <JCHEM_REFRACTIVITY>
67.2699

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
5.11e-02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
helenine

> <JCHEM_VEBER_RULE>
1

$$$$

HEADER    PROTEIN                                 28-APR-22   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   28-APR-22         0                                  
HETATM    1  C   UNK     0       2.667   0.000   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       4.001  -0.770   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       5.335   0.000   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       6.668  -0.770   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       6.668  -2.310   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       5.335  -3.080   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       4.001  -2.310   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       2.667  -3.080   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       1.334  -2.310   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       1.334  -0.770   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       4.001  -3.850   0.000  0.00  0.00           C+0
HETATM   12  O   UNK     0       8.133  -2.786   0.000  0.00  0.00           O+0
HETATM   13  C   UNK     0       9.038  -1.540   0.000  0.00  0.00           C+0
HETATM   14  O   UNK     0      10.578  -1.540   0.000  0.00  0.00           O+0
HETATM   15  C   UNK     0       8.133  -0.294   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       8.609   1.171   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       2.667   1.540   0.000  0.00  0.00           C+0
CONECT    1    2   10   17                                                  
CONECT    2    1    3    7                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5   15                                                  
CONECT    5    4    6   12                                                  
CONECT    6    5    7                                                       
CONECT    7    6    2    8   11                                             
CONECT    8    7    9                                                       
CONECT    9    8   10                                                       
CONECT   10    9    1                                                       
CONECT   11    7                                                            
CONECT   12    5   13                                                       
CONECT   13   12   14   15                                                  
CONECT   14   13                                                            
CONECT   15   13    4   16                                                  
CONECT   16   15                                                            
CONECT   17    1                                                            
MASTER        0    0    0    0    0    0    0    0   17    0   38    0
END

View in JSmol

Synonyms

Value	Source
Alant camphor	ChEBI
Elecampane camphor	ChEBI
Eupatal	ChEBI
Helenine	ChEBI
Inula camphor	ChEBI
Helenin	MeSH

Chemical Formula

C₁₅H₂₀O₂

Average Mass

232.3230 Da

Monoisotopic Mass

232.14633 Da

IUPAC Name

(3aR,5S,8aR,9aR)-5,8a-dimethyl-3-methylidene-2H,3H,3aH,5H,6H,7H,8H,8aH,9H,9aH-naphtho[2,3-b]furan-2-one

Traditional Name

helenine

CAS Registry Number

Not Available

SMILES

C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)C(=C)[C@H]3C=C12

InChI Identifier

InChI=1S/C15H20O2/c1-9-5-4-6-15(3)8-13-11(7-12(9)15)10(2)14(16)17-13/h7,9,11,13H,2,4-6,8H2,1,3H3/t9-,11+,13+,15+/m0/s1

InChI Key

PXOYOCNNSUAQNS-AGNJHWRGSA-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, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 252 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 50 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 75 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 101 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 126 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 151 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 176 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 201 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, 226 MHz, D₂O, predicted)	Wishart Lab	Wishart Lab	David Wishart	2021-06-20	View Spectrum
1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, 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
Abutilon indicum	Plant	KNApSAcK
Ajania fruticulosa	Plant	KNApSAcK
Artemisia maritima	LOTUS Database	35616633
Bidens subalternans	LOTUS Database	35616633
Chrysanthemum morifolium	LOTUS Database	35616633
Eupatorium cannabinum	LOTUS Database	35616633
Geigeria brevifolia	LOTUS Database	35616633
Inula caspica	LOTUS Database	35616633
Inula grandis	Plant	KNApSAcK
Inula helenium	Plant	KNApSAcK
Inula japonica	LOTUS Database	35616633
Inula magnifica	Plant	KNApSAcK
Inula racemosa	Plant	KNApSAcK
Inula royleana	Plant	KNApSAcK
Inula salicina	Plant	KNApSAcK
Kerria japonica	Plant	KNApSAcK
Klasea latifolia	LOTUS Database	35616633
Saussurea costus	Plant	KNApSAcK
Tagetes patula	Plant	KNApSAcK
Tanacetum parthenium	LOTUS Database	35616633
Telekia speciosa	LOTUS Database	35616633

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as eudesmanolides, secoeudesmanolides, and derivatives. These are terpenoids with a structure based on the eudesmanolide (a 3,5a,9-trimethyl-naphtho[1,2-b]furan-2-one derivative) or secoeudesmanolide (a 3,6-dimethyl-5-(pentan-2-yl)-1-benzofuran-2-one derivative) skeleton.

Kingdom

Organic compounds

Super Class

Lipids and lipid-like molecules

Class

Prenol lipids

Sub Class

Terpene lactones

Direct Parent

Eudesmanolides, secoeudesmanolides, and derivatives

Alternative Parents

Substituents

Eudesmanolide
Sesquiterpenoid
Naphthofuran
Gamma butyrolactone
Tetrahydrofuran
Enoate ester
Alpha,beta-unsaturated carboxylic ester
Lactone
Carboxylic acid ester
Oxacycle
Monocarboxylic acid or derivatives
Carboxylic acid derivative
Organoheterocyclic compound
Organooxygen compound
Hydrocarbon derivative
Organic oxide
Organic oxygen compound
Carbonyl group
Aliphatic heteropolycyclic compound

Molecular Framework

Aliphatic heteropolycyclic compounds

External Descriptors

olefinic compound (CHEBI:2540 )
sesquiterpene lactone (CHEBI:2540 )
naphthofuran (CHEBI:2540 )
Eudesmane sesquiterpenoids (C09289 )
Eudesmanes (C09289 )
Eudesmane sesquiterpenoids (LMPR0103190013 )

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	4.13	ALOGPS
logP	3.3	ChemAxon
logS	-3.7	ALOGPS
pKa (Strongest Basic)	-6.9	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	1	ChemAxon
Hydrogen Donor Count	0	ChemAxon
Polar Surface Area	26.3 Å²	ChemAxon
Rotatable Bond Count	0	ChemAxon
Refractivity	67.27 m³·mol⁻¹	ChemAxon
Polarizability	26.15 Å³	ChemAxon
Number of Rings	3	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	Yes	ChemAxon
Veber's Rule	Yes	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

C00012893

Chemspider ID

65564

KEGG Compound ID

C09289

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Helenin

METLIN ID

Not Available

PubChem Compound

72724

PDB ID

Not Available

ChEBI ID

2540

Good Scents ID

rw1389041

References

General References

Cai X, Yang C, Qin G, Zhang M, Bi Y, Qiu X, Lu L, Chen H: Antimicrobial Effects and Active Compounds of the Root of Aucklandia Lappa Decne (Radix Aucklandiae). Front Chem. 2022 Apr 6;10:872480. doi: 10.3389/fchem.2022.872480. eCollection 2022. [PubMed:35464223 ]
Anju VT, Busi S, Kumar S, Suchiang K, Kumavath R, Ranganathan S, Ampasala DR, Dyavaiah M: Alantolactone modulates the production of quorum sensing mediated virulence factors and biofilm formation in Pseudomonas aeruginosa. Biofouling. 2022 Apr;38(4):331-347. doi: 10.1080/08927014.2022.2064747. Epub 2022 Apr 25. [PubMed:35469529 ]
Fu Z, Li S, Liu J, Zhang C, Jian C, Wang L, Zhang Y, Shi C: Natural Product Alantolactone Targeting AKR1C1 Suppresses Cell Proliferation and Metastasis in Non-Small-Cell Lung Cancer. Front Pharmacol. 2022 Mar 15;13:847906. doi: 10.3389/fphar.2022.847906. eCollection 2022. [PubMed:35370661 ]
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Ding Y, Zhen Z, Nisar MA, Ali F, Din RU, Khan M, Mughal TA, Alam G, Liu L, Saleem MZ: Sesquiterpene Lactones Attenuate Paclitaxel Resistance Via Inhibiting MALAT1/STAT3/ FUT4 Axis and P-Glycoprotein Transporters in Lung Cancer Cells. Front Pharmacol. 2022 Feb 24;13:795613. doi: 10.3389/fphar.2022.795613. eCollection 2022. [PubMed:35281907 ]

Showing NP-Card for (+)-Alantolactone (NP0059360)

MOL for NP0059360 ((+)-Alantolactone)

3D MOL for NP0059360 ((+)-Alantolactone)

3D SDF for NP0059360 ((+)-Alantolactone)

3D-SDF for NP0059360 ((+)-Alantolactone)

PDB for NP0059360 ((+)-Alantolactone)

3D PDB for NP0059360 ((+)-Alantolactone)

SMILES for NP0059360 ((+)-Alantolactone)

INCHI for NP0059360 ((+)-Alantolactone)

Structure for NP0059360 ((+)-Alantolactone)

3D Structure for NP0059360 ((+)-Alantolactone)