6MA

N6-METHYL-DEOXY-ADENOSINE-5'-MONOPHOSPHATE

Created:	2003-02-05
Last modified:	2011-06-04

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1 entries where 6MA is found as a standalone ligand42 entries where 6MA is found in a polymer sequence

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Chemical Details
Formal Charge	0
Atom Count	39
Chiral Atom Count	3
Bond Count	41
Aromatic Bond Count	10

2D diagram of 6MA

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Chemical Component Summary
Name	N6-METHYL-DEOXY-ADENOSINE-5'-MONOPHOSPHATE
Systematic Name (OpenEye OEToolkits)	[(2R,3S,5R)-3-hydroxy-5-[6-(methylamino)purin-9-yl]oxolan-2-yl]methyl dihydrogen phosphate
Formula	C₁₁ H₁₆ N₅ O₆ P
Molecular Weight	345.248
Type	DNA LINKING

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=P(O)(O)OCC3OC(n2cnc1c(ncnc12)NC)CC3O
SMILES	CACTVS	3.370	CNc1ncnc2n(cnc12)[CH]3C[CH](O)[CH](CO[P](O)(O)=O)O3
SMILES	OpenEye OEToolkits	1.7.0	CNc1c2c(ncn1)n(cn2)C3CC(C(O3)COP(=O)(O)O)O
Canonical SMILES	CACTVS	3.370	CNc1ncnc2n(cnc12)[C@H]3C[C@H](O)[C@@H](CO[P](O)(O)=O)O3
Canonical SMILES	OpenEye OEToolkits	1.7.0	CNc1c2c(ncn1)n(cn2)[C@H]3C[C@@H]([C@H](O3)COP(=O)(O)O)O
InChI	InChI	1.03	InChI=1S/C11H16N5O6P/c1-12-10-9-11(14-4-13-10)16(5-15-9)8-2-6(17)7(22-8)3-21-23(18,19)20/h4-8,17H,2-3H2,1H3,(H,12,13,14)(H2,18,19,20)/t6-,7+,8+/m0/s1
InChIKey	InChI	1.03	MGKYNCZAQIZDCV-XLPZGREQSA-N

Related Resource References

Resource Name	Reference
PubChem	49866558

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