6SX

Purine riboside-3',5'-cyclic monophosphate

Created:	2016-06-16
Last modified:	2021-03-01

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1 entries where 6SX is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	32
Chiral Atom Count	4
Bond Count	35
Aromatic Bond Count	10

2D diagram of 6SX

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Chemical Component Summary
Name	Purine riboside-3',5'-cyclic monophosphate
Synonyms	cPuMP
Systematic Name (OpenEye OEToolkits)	(4~{a}~{R},6~{R},7~{R},7~{a}~{S})-2-oxidanyl-2-oxidanylidene-6-purin-9-yl-4~{a},6,7,7~{a}-tetrahydro-4~{H}-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol
Formula	C₁₀ H₁₁ N₄ O₆ P
Molecular Weight	314.191
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	O[CH]1[CH]2O[P](O)(=O)OC[CH]2O[CH]1n3cnc4cncnc34
SMILES	OpenEye OEToolkits	2.0.5	c1c2c(ncn1)n(cn2)C3C(C4C(O3)COP(=O)(O4)O)O
Canonical SMILES	CACTVS	3.385	O[C@@H]1[C@@H]2O[P](O)(=O)OC[C@H]2O[C@H]1n3cnc4cncnc34
Canonical SMILES	OpenEye OEToolkits	2.0.5	c1c2c(ncn1)n(cn2)[C@H]3[C@@H]([C@H]4[C@H](O3)COP(=O)(O4)O)O
InChI	InChI	1.03	InChI=1S/C10H11N4O6P/c15-7-8-6(2-18-21(16,17)20-8)19-10(7)14-4-13-5-1-11-3-12-9(5)14/h1,3-4,6-8,10,15H,2H2,(H,16,17)/t6-,7-,8-,10-/m1/s1
InChIKey	InChI	1.03	AVSJXTVPIHQRPY-FDDDBJFASA-N

Related Resource References

Resource Name	Reference
PubChem	14258195
ChEBI	CHEBI:84626

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.