23G

GUANOSINE-5'-PHOSPHATE-2',3'-CYCLIC PHOSPHATE

Created:	2009-09-09
Last modified:	2011-06-04

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1 entries where 23G is found as a standalone ligand20 entries where 23G is found in a polymer sequence

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Chemical Details
Formal Charge	0
Atom Count	40
Chiral Atom Count	4
Bond Count	43
Aromatic Bond Count	5

2D diagram of 23G

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Chemical Component Summary
Name	GUANOSINE-5'-PHOSPHATE-2',3'-CYCLIC PHOSPHATE
Systematic Name (OpenEye OEToolkits)	[(1R,3S,5R,6R,8R)-8-(2-azanyl-6-oxo-1H-purin-9-yl)-3-hydroxy-3-oxo-2,4,7-trioxa-3$l^{5}-phosphabicyclo[3.3.0]octan-6-yl]methyl dihydrogen phosphate
Formula	C₁₀ H₁₃ N₅ O₁₀ P₂
Molecular Weight	425.185
Type	RNA OH 3 PRIME TERMINUS

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	11.02	O=C4NC(=Nc1c4ncn1C2OC(C3OP(=O)(O)OC23)COP(=O)(O)O)N
SMILES	CACTVS	3.352	NC1=Nc2n(cnc2C(=O)N1)[CH]3O[CH](CO[P](O)(O)=O)[CH]4O[P](O)(=O)O[CH]34
SMILES	OpenEye OEToolkits	1.7.0	c1nc2c(n1C3C4C(C(O3)COP(=O)(O)O)OP(=O)(O4)O)N=C(NC2=O)N
Canonical SMILES	CACTVS	3.352	NC1=Nc2n(cnc2C(=O)N1)[C@@H]3O[C@H](CO[P](O)(O)=O)[C@H]4O[P](O)(=O)O[C@@H]34
Canonical SMILES	OpenEye OEToolkits	1.7.0	c1nc2c(n1[C@H]3[C@H]4[C@@H]([C@H](O3)COP(=O)(O)O)O[P@@](=O)(O4)O)N=C(NC2=O)N
InChI	InChI	1.03	InChI=1S/C10H13N5O10P2/c11-10-13-7-4(8(16)14-10)12-2-15(7)9-6-5(24-27(20,21)25-6)3(23-9)1-22-26(17,18)19/h2-3,5-6,9H,1H2,(H,20,21)(H2,17,18,19)(H3,11,13,14,16)/t3-,5-,6-,9-/m1/s1
InChIKey	InChI	1.03	ZBMMALUAVDLKSL-UUOKFMHZSA-N

Related Resource References

Resource Name	Reference
PubChem	49866435, 136254572
ChEBI	CHEBI:72329

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