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Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2006-05-22 14:17:36 UTC

Update Date

2023-02-21 17:16:09 UTC

HMDB ID

HMDB0002099

Secondary Accession Numbers

HMDB02099

Metabolite Identification

Common Name

6-Methyladenine

Description

6-Methyladenine is a methylated adenine residue. The formation of internal 6-methyladenine (m6A) residues in eucaryotic messenger RNA (mRNA) is a postsynthetic modification in which S-adenosyl-L-methionine (SAM) serves as the methyl donor. 6-Methyladenine residues have also been localized to heterogeneous nuclear RNA (HnRNA), and for the most part these residues are conserved during mRNA processing. Although the biological significance of internal adenine methylation in eucaryotic mRNA remains unclear, a great deal of research has indicated that this modification may be required for mRNA transport to the cytoplasm, the selection of splice sites or other RNA processing reactions. The presence of m6A residues increases the in vitro translation efficiency of dihydrofolate reductase; an inhibition of m6A residues in dihydrofolate reductase transcripts significantly alters their rate of translation. m6A is found in many human fluids: oviductal fluid, blood plasma and urine (PMID:1551452 , 8925412 , 10481270 , 16083005 , 16684535 , 3506820 , 3728186 ).

Structure

MOL 3D MOL SDF 3D SDF PDB 3D PDB SMILES InChI

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
6-MAP	ChEBI
6-Methylaminopurine	ChEBI
N6-Methyladenine	ChEBI
N6-Monomethyladenine	ChEBI
(N-6)-Methyladenine	HMDB
6-(methylamino)Purine	HMDB
6-Monomethylaminopurine	HMDB
Methyl(purin-6-yl)amine	HMDB
N-6-Methyladenine	HMDB
N-Methyl-9H-purin-6-amine	HMDB
N-Methyl-adenine	HMDB
N-Methyl-N-(9H-purin-6-yl)amine	HMDB
N-Methyladenine	HMDB
N(6)-Methyladenine	MeSH, HMDB
6-Methyladenine	ChEBI

Chemical Formula

C₆H₇N₅

Average Molecular Weight

149.1533

Monoisotopic Molecular Weight

149.070145249

IUPAC Name

N-methyl-7H-purin-6-amine

Traditional Name

6-(methylamino)purine

CAS Registry Number

443-72-1

SMILES

CNC1=NC=NC2=C1NC=N2

InChI Identifier

InChI=1S/C6H7N5/c1-7-5-4-6(10-2-8-4)11-3-9-5/h2-3H,1H3,(H2,7,8,9,10,11)

InChI Key

CKOMXBHMKXXTNW-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as 6-alkylaminopurines. 6-Alkylaminopurines are compounds that contain an alkylamine group attached at the 6-position of a purine. Purine is a bicyclic aromatic compound made up of a pyrimidine ring fused to an imidazole ring.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Imidazopyrimidines

Sub Class

Purines and purine derivatives

Direct Parent

6-alkylaminopurines

Alternative Parents

Substituents

6-alkylaminopurine
Aminopyrimidine
Secondary aliphatic/aromatic amine
Pyrimidine
Imidolactam
Azole
Imidazole
Heteroaromatic compound
Secondary amine
Azacycle
Hydrocarbon derivative
Organopnictogen compound
Organonitrogen compound
Organic nitrogen compound
Amine
Aromatic heteropolycyclic compound

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

methyladenine (CHEBI:28871 )
6-alkylaminopurine (CHEBI:28871 )

Ontology

Not Available

Endogenous (HMDB: HMDB0002099)

Greylag goose (FooDB: FOOD00368)
Guinea hen (FooDB: FOOD00373)
Ostrich (FooDB: FOOD00422)
Velvet duck (FooDB: FOOD00427)
Pheasant (FooDB: FOOD00430)
Squab (FooDB: FOOD00481)
Turkey (FooDB: FOOD00494)
Quail (FooDB: FOOD00541)
Anatidae (FooDB: FOOD00576)
Rock ptarmigan (FooDB: FOOD00597)
Columbidae (Dove, Pigeon) (FooDB: FOOD00610)
Chicken (FooDB: FOOD00329)
Mallard duck (FooDB: FOOD00353)
Emu (FooDB: FOOD00360)

Equine

Horse (FooDB: FOOD00378)

Lagomorph

Ovis

Sheep (Mutton, Lamb) (FooDB: FOOD00473)

Bovine

Venison

Deer (FooDB: FOOD00524)
Mule deer (FooDB: FOOD00348)
Elk (FooDB: FOOD00359)

Caprae

Domestic goat (FooDB: FOOD00529)

Swine

Domestic pig (FooDB: FOOD00536)
Wild boar (FooDB: FOOD00307)

Process

Not Available

Role

Not Available

Physical Properties

State

Solid

Experimental Molecular Properties

Property	Value	Reference
Melting Point	Not Available	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	1.18 mg/mL at 20 °C	Not Available
LogP	Not Available	Not Available

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
Water Solubility	0.94 g/L	ALOGPS
logP	0.19	ALOGPS
logP	-0.27	ChemAxon
logS	-2.2	ALOGPS
pKa (Strongest Acidic)	10.24	ChemAxon
pKa (Strongest Basic)	3.49	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	4	ChemAxon
Hydrogen Donor Count	2	ChemAxon
Polar Surface Area	66.49 Å²	ChemAxon
Rotatable Bond Count	1	ChemAxon
Refractivity	43.71 m³·mol⁻¹	ChemAxon
Polarizability	14.43 Å³	ChemAxon
Number of Rings	2	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DarkChem	[M+H]+	131.411	31661259
DarkChem	[M-H]-	130.829	31661259
DeepCCS	[M+H]+	129.0	30932474
DeepCCS	[M-H]-	126.314	30932474
DeepCCS	[M-2H]-	163.109	30932474
DeepCCS	[M+Na]+	137.898	30932474
AllCCS	[M+H]+	132.7	32859911
AllCCS	[M+H-H2O]+	128.0	32859911
AllCCS	[M+NH4]+	137.0	32859911
AllCCS	[M+Na]+	138.2	32859911
AllCCS	[M-H]-	128.6	32859911
AllCCS	[M+Na-2H]-	129.6	32859911
AllCCS	[M+HCOO]-	130.7	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
6-Methyladenine	CNC1=NC=NC2=C1NC=N2	2364.6	Standard polar	33892256
6-Methyladenine	CNC1=NC=NC2=C1NC=N2	1774.3	Standard non polar	33892256
6-Methyladenine	CNC1=NC=NC2=C1NC=N2	1851.9	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
6-Methyladenine,1TMS,isomer #1	CN(C1=NC=NC2=C1[NH]C=N2)[Si](C)(C)C	1835.8	Semi standard non polar	33892256
6-Methyladenine,1TMS,isomer #1	CN(C1=NC=NC2=C1[NH]C=N2)[Si](C)(C)C	1792.5	Standard non polar	33892256
6-Methyladenine,1TMS,isomer #1	CN(C1=NC=NC2=C1[NH]C=N2)[Si](C)(C)C	2688.1	Standard polar	33892256
6-Methyladenine,1TMS,isomer #2	CNC1=NC=NC2=C1N([Si](C)(C)C)C=N2	1901.7	Semi standard non polar	33892256
6-Methyladenine,1TMS,isomer #2	CNC1=NC=NC2=C1N([Si](C)(C)C)C=N2	1719.9	Standard non polar	33892256
6-Methyladenine,1TMS,isomer #2	CNC1=NC=NC2=C1N([Si](C)(C)C)C=N2	2752.0	Standard polar	33892256
6-Methyladenine,2TMS,isomer #1	CN(C1=NC=NC2=C1N([Si](C)(C)C)C=N2)[Si](C)(C)C	1876.6	Semi standard non polar	33892256
6-Methyladenine,2TMS,isomer #1	CN(C1=NC=NC2=C1N([Si](C)(C)C)C=N2)[Si](C)(C)C	1823.2	Standard non polar	33892256
6-Methyladenine,2TMS,isomer #1	CN(C1=NC=NC2=C1N([Si](C)(C)C)C=N2)[Si](C)(C)C	2351.1	Standard polar	33892256
6-Methyladenine,1TBDMS,isomer #1	CN(C1=NC=NC2=C1[NH]C=N2)[Si](C)(C)C(C)(C)C	2068.3	Semi standard non polar	33892256
6-Methyladenine,1TBDMS,isomer #1	CN(C1=NC=NC2=C1[NH]C=N2)[Si](C)(C)C(C)(C)C	1988.9	Standard non polar	33892256
6-Methyladenine,1TBDMS,isomer #1	CN(C1=NC=NC2=C1[NH]C=N2)[Si](C)(C)C(C)(C)C	2802.3	Standard polar	33892256
6-Methyladenine,1TBDMS,isomer #2	CNC1=NC=NC2=C1N([Si](C)(C)C(C)(C)C)C=N2	2116.6	Semi standard non polar	33892256
6-Methyladenine,1TBDMS,isomer #2	CNC1=NC=NC2=C1N([Si](C)(C)C(C)(C)C)C=N2	1903.7	Standard non polar	33892256
6-Methyladenine,1TBDMS,isomer #2	CNC1=NC=NC2=C1N([Si](C)(C)C(C)(C)C)C=N2	2831.2	Standard polar	33892256
6-Methyladenine,2TBDMS,isomer #1	CN(C1=NC=NC2=C1N([Si](C)(C)C(C)(C)C)C=N2)[Si](C)(C)C(C)(C)C	2274.8	Semi standard non polar	33892256
6-Methyladenine,2TBDMS,isomer #1	CN(C1=NC=NC2=C1N([Si](C)(C)C(C)(C)C)C=N2)[Si](C)(C)C(C)(C)C	2237.7	Standard non polar	33892256
6-Methyladenine,2TBDMS,isomer #1	CN(C1=NC=NC2=C1N([Si](C)(C)C(C)(C)C)C=N2)[Si](C)(C)C(C)(C)C	2519.9	Standard polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - 6-Methyladenine GC-MS (Non-derivatized) - 70eV, Positive	splash10-00dj-1900000000-4388236e2ed64fa86485	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 6-Methyladenine GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Experimental LC-MS/MS	LC-MS/MS Spectrum - 6-Methyladenine LC-ESI-QQ (API3000, Applied Biosystems) 10V, Negative-QTOF	splash10-0002-0900000000-ebccac10312d914083da	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - 6-Methyladenine LC-ESI-QQ (API3000, Applied Biosystems) 20V, Negative-QTOF	splash10-0002-0900000000-acd38df5c1893ac9af76	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - 6-Methyladenine LC-ESI-QQ (API3000, Applied Biosystems) 30V, Negative-QTOF	splash10-001i-0900000000-f9139c5b6ccbec800e53	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - 6-Methyladenine LC-ESI-QQ (API3000, Applied Biosystems) 40V, Negative-QTOF	splash10-001i-1900000000-7a5ba4a964d60f60ecb0	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - 6-Methyladenine LC-ESI-QQ (API3000, Applied Biosystems) 50V, Negative-QTOF	splash10-00lr-6900000000-006dc8e68d6ad9644090	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - 6-Methyladenine LC-ESI-QQ , negative-QTOF	splash10-0002-0900000000-ebccac10312d914083da	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - 6-Methyladenine LC-ESI-QQ , negative-QTOF	splash10-0002-0900000000-306d0a3a86a82c8e9c2d	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - 6-Methyladenine LC-ESI-QQ , negative-QTOF	splash10-001i-0900000000-f9139c5b6ccbec800e53	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - 6-Methyladenine LC-ESI-QQ , negative-QTOF	splash10-001i-1900000000-7a5ba4a964d60f60ecb0	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - 6-Methyladenine LC-ESI-QQ , negative-QTOF	splash10-00lr-6900000000-a9aecd02881bc63a44cf	2017-09-14	HMDB team, MONA	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 6-Methyladenine 10V, Positive-QTOF	splash10-0udi-0900000000-95e5ff9c45c543613646	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 6-Methyladenine 20V, Positive-QTOF	splash10-0udi-0900000000-d725eaa6bb993c0825d1	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 6-Methyladenine 40V, Positive-QTOF	splash10-0q34-9500000000-1d36feb5463dedb4b939	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 6-Methyladenine 10V, Negative-QTOF	splash10-0002-0900000000-d994d99b1fbee490b9c1	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 6-Methyladenine 20V, Negative-QTOF	splash10-0002-0900000000-0219b6e174726015e92e	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 6-Methyladenine 40V, Negative-QTOF	splash10-0a4i-9500000000-bdc2edc9722c931b492d	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 6-Methyladenine 10V, Negative-QTOF	splash10-0002-0900000000-0fdae69660ea9759916e	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 6-Methyladenine 20V, Negative-QTOF	splash10-0002-0900000000-91ca82897e368d407285	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 6-Methyladenine 40V, Negative-QTOF	splash10-066s-4900000000-13a3c96e59d3df0511ab	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 6-Methyladenine 10V, Positive-QTOF	splash10-0udi-0900000000-18eefbc35459f26a6570	2021-09-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 6-Methyladenine 20V, Positive-QTOF	splash10-0udi-0900000000-18eefbc35459f26a6570	2021-09-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 6-Methyladenine 40V, Positive-QTOF	splash10-0006-9100000000-42405660fb0f8bcc5c23	2021-09-25	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Experimental 1D NMR	¹H NMR Spectrum (1D, 600 MHz, 100%_DMSO, experimental)	2012-12-05	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-29	Wishart Lab	View Spectrum
Experimental 2D NMR	[¹H, ¹³C]-HSQC NMR Spectrum (2D, 600 MHz, 100%_DMSO, experimental)	2012-12-05	Wishart Lab	View Spectrum

IR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted IR Spectrum	IR Ion Spectrum (Predicted IRIS Spectrum, Adduct: [M-H]-)	2023-02-03	FELIX lab	View Spectrum
Predicted IR Spectrum	IR Ion Spectrum (Predicted IRIS Spectrum, Adduct: [M+H]+)	2023-02-03	FELIX lab	View Spectrum
Predicted IR Spectrum	IR Ion Spectrum (Predicted IRIS Spectrum, Adduct: [M+Na]+)	2023-02-03	FELIX lab	View Spectrum

Biological Properties

Cellular Locations

Not Available

Biospecimen Locations

Not Available

Tissue Locations

Not Available

Pathways

Not Available

Name	SMPDB/PathBank	KEGG

Normal Concentrations

Not Available

Abnormal Concentrations

Not Available

Associated Disorders and Diseases

Disease References

None

Associated OMIM IDs

None

External Links

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FooDB ID

FDB022845

KNApSAcK ID

Not Available

Chemspider ID

61270

KEGG Compound ID

C08434

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

67955

PDB ID

Not Available

ChEBI ID

28871

Food Biomarker Ontology

Not Available

VMH ID

Not Available

MarkerDB ID

Not Available

Good Scents ID

Not Available

References

Synthesis Reference

Elion, Gertrude B. Some new N-methylpurines. Ciba Foundation Symposium, Chem. and Biol. Purines (1957), 39-49.

Material Safety Data Sheet (MSDS)

Download (PDF)

General References

Morris GS, Simmonds HA, Davies PM: Use of biological fluids for the rapid diagnosis of potentially lethal inherited disorders of human purine and pyrimidine metabolism. Biomed Chromatogr. 1986 Jun;1(3):109-18. [PubMed:3506820 ]
Tuck MT: The formation of internal 6-methyladenine residues in eucaryotic messenger RNA. Int J Biochem. 1992 Mar;24(3):379-86. [PubMed:1551452 ]
Heilman KL, Leach RA, Tuck MT: Internal 6-methyladenine residues increase the in vitro translation efficiency of dihydrofolate reductase messenger RNA. Int J Biochem Cell Biol. 1996 Jul;28(7):823-9. [PubMed:8925412 ]
Tuck MT, Wiehl PE, Pan T: Inhibition of 6-methyladenine formation decreases the translation efficiency of dihydrofolate reductase transcripts. Int J Biochem Cell Biol. 1999 Aug;31(8):837-51. [PubMed:10481270 ]
Baniushin BF: [Methylation of adenine residues in DNA of eukaryotes]. Mol Biol (Mosk). 2005 Jul-Aug;39(4):557-66. [PubMed:16083005 ]
Ratel D, Ravanat JL, Charles MP, Platet N, Breuillaud L, Lunardi J, Berger F, Wion D: Undetectable levels of N6-methyl adenine in mouse DNA: Cloning and analysis of PRED28, a gene coding for a putative mammalian DNA adenine methyltransferase. FEBS Lett. 2006 May 29;580(13):3179-84. Epub 2006 May 3. [PubMed:16684535 ]
Morris GS, Simmonds HA: A single system for the evaluation of purine and pyrimidine nucleosides and bases together with their analogues in biological fluids. Adv Exp Med Biol. 1986;195 Pt A:593-9. [PubMed:3728186 ]

Showing metabocard for 6-Methyladenine (HMDB0002099)

MOL for HMDB0002099 (6-Methyladenine)

3D MOL for HMDB0002099 (6-Methyladenine)

3D SDF for HMDB0002099 (6-Methyladenine)

3D-SDF for HMDB0002099 (6-Methyladenine)

PDB for HMDB0002099 (6-Methyladenine)

3D PDB for HMDB0002099 (6-Methyladenine)

SMILES for HMDB0002099 (6-Methyladenine)

INCHI for HMDB0002099 (6-Methyladenine)

Structure for HMDB0002099 (6-Methyladenine)

3D Structure for HMDB0002099 (6-Methyladenine)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra

IR Spectra