6MZ

N6-METHYLADENOSINE-5'-MONOPHOSPHATE

Created:	2007-03-21
Last modified:	2018-03-14

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2 entries where 6MZ is found as a standalone ligand424 entries where 6MZ is found in a polymer sequence

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Chemical Details
Formal Charge	0
Atom Count	40
Chiral Atom Count	4
Bond Count	42
Aromatic Bond Count	10

2D diagram of 6MZ

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Chemical Component Summary
Name	N6-METHYLADENOSINE-5'-MONOPHOSPHATE
Systematic Name (OpenEye OEToolkits)	[(2R,3S,4R,5R)-5-[6-(methylamino)purin-9-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate
Formula	C₁₁ H₁₆ N₅ O₇ P
Molecular Weight	361.248
Type	RNA LINKING

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	c1nc2c(c(n1)NC)ncn2C3OC(COP(O)(=O)O)C(C3O)O
SMILES	CACTVS	3.385	CNc1ncnc2n(cnc12)[CH]3O[CH](CO[P](O)(O)=O)[CH](O)[CH]3O
SMILES	OpenEye OEToolkits	1.7.6	CNc1c2c(ncn1)n(cn2)C3C(C(C(O3)COP(=O)(O)O)O)O
Canonical SMILES	CACTVS	3.385	CNc1ncnc2n(cnc12)[C@@H]3O[C@H](CO[P](O)(O)=O)[C@@H](O)[C@H]3O
Canonical SMILES	OpenEye OEToolkits	1.7.6	CNc1c2c(ncn1)n(cn2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O
InChI	InChI	1.03	InChI=1S/C11H16N5O7P/c1-12-9-6-10(14-3-13-9)16(4-15-6)11-8(18)7(17)5(23-11)2-22-24(19,20)21/h3-5,7-8,11,17-18H,2H2,1H3,(H,12,13,14)(H2,19,20,21)/t5-,7-,8-,11-/m1/s1
InChIKey	InChI	1.03	WETVNPRPZIYMAC-IOSLPCCCSA-N

Related Resource References

Resource Name	Reference
PubChem	16760025
ChEMBL	CHEMBL1230507
ChEBI	CHEBI:40196

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