Marvin  12211016252D          

 23 26  0  0  1  0            999 V2000
   11.5970  -15.1467    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   11.3429  -15.8987    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   12.3629  -14.8996    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.9182  -14.6420    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5180  -15.8917    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.5935  -16.6819    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9999  -15.3382    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6483  -14.0677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2638  -15.1120    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.2604  -16.6749    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9252  -17.1623    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   13.7344  -14.7986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0800  -16.1841    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.5116  -14.0746    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.4702  -14.8544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5100  -17.7506    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3264  -17.7506    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.4793  -15.1294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8667  -16.5357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8505  -15.4113    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5769  -16.0136    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.1372  -14.6385    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9641  -17.4129    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  1  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  6  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  6  0  0  0
  6 11  1  0  0  0  0
  7 12  2  0  0  0  0
  7 13  1  0  0  0  0
  8 14  2  0  0  0  0
  9 15  1  1  0  0  0
 11 16  1  0  0  0  0
 11 17  2  0  0  0  0
 12 18  1  0  0  0  0
 13 19  2  0  0  0  0
 15 20  1  0  0  0  0
 18 21  1  0  0  0  0
 18 22  2  0  0  0  0
 19 23  1  0  0  0  0
  5  9  1  0  0  0  0
 10 11  1  0  0  0  0
 12 14  1  0  0  0  0
 19 21  1  0  0  0  0
M  END
> <ID>
CHEBI:28181

> <NAME>
2',3'-cyclic GMP

> <DEFINITION>
A 2',3'-cyclic purine nucleotide in which guanosine is used as the parent nucleoside.

> <STAR>
3

> <SECONDARY_ID>
CHEBI:825; CHEBI:19214

> <SYNONYM>
O(2'),O(3')-hydroxyphosphoryl-guanosine; guanosine cyclic-2',3'-monophosphate; guanosine cyclic 2',3'-(hydrogen phosphate); guanosine 2',3'-cyclic phosphate; guanosine 2',3'-cyclic monophosphate; cyclic guanosine 2',3'-monophosphate; 2',3'-Cyclic GMP

> <IUPAC_NAME>
2-amino-9-[(3aR,4R,6R,6aR)-2-hydroxy-6-(hydroxymethyl)-2-oxidotetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-4-yl]-1,9-dihydro-6H-purin-6-one

> <FORMULA>
C10H12N5O7P

> <MASS>
345.20530

> <MONOISOTOPIC_MASS>
345.04743

> <CHARGE>
0

> <SMILES>
Nc1nc2n(cnc2c(=O)[nH]1)[C@@H]1O[C@H](CO)[C@H]2OP(O)(=O)O[C@@H]12

> <INCHI>
InChI=1S/C10H12N5O7P/c11-10-13-7-4(8(17)14-10)12-2-15(7)9-6-5(3(1-16)20-9)21-23(18,19)22-6/h2-3,5-6,9,16H,1H2,(H,18,19)(H3,11,13,14,17)/t3-,5-,6-,9-/m1/s1

> <INCHIKEY>
UASRYODFRYWBRC-UUOKFMHZSA-N

> <CAS_REGISTRY_NUMBER>
634-02-6

> <REAXYS_REGISTRY_NUMBER>
59789

> <CHEMIDPLUS>
634-02-6

> <KEGG_COMPOUND_ACCESSION>
C06194

> <METACYC_ACCESSION>
CPD-3709

$$$$