Mrv0541 01141412022D          

 20 22  0  0  0  0            999 V2000
    5.9789    0.6015    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.6953    1.0148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6925    1.8453    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.9771    2.2545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2641    1.0143    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2653    1.8387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4817    2.0946    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9961    1.4284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4797    0.7608    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.9733    3.0795    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2260   -0.0207    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.4410   -0.2745    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4398   -1.0996    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.2241   -1.3557    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.7099   -0.6889    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.7717   -1.5835    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0185   -1.2468    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4780   -2.1406    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5349   -0.6901    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9464   -1.4051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  4  6  1  0  0  0  0
  4 10  1  0  0  0  0
 11 12  1  0  0  0  0
  5  6  2  0  0  0  0
  1  2  2  0  0  0  0
  5  1  1  0  0  0  0
  2  3  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 11  1  0  0  0  0
 11  9  1  1  0  0  0
  3  4  2  0  0  0  0
 13 16  1  1  0  0  0
  6  7  1  0  0  0  0
 16 17  1  0  0  0  0
  7  8  2  0  0  0  0
 14 18  1  6  0  0  0
  8  9  1  0  0  0  0
 15 19  1  6  0  0  0
  9  5  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
> <ID>
CHEBI:69426

> <NAME>
cordysinin B

> <DEFINITION>
A member of the class of adenosines that is adenosine in which the hydroxy group at position 2ʼ is replaced by a methoxy group. It has been isolated from the mycelia of Cordyceps sinensis.

> <STAR>
3

> <SYNONYM>
2'-O-Me-A; (2R,3R,4R,5R)-5-(6-amino-9H-purin-9-yl)-2-(hydroxymethyl)-4-methoxytetrahydrofuran-3-ol

> <IUPAC_NAME>
2'-O-methyladenosine

> <FORMULA>
C11H15N5O4

> <MASS>
281.26790

> <MONOISOTOPIC_MASS>
281.11240

> <CHARGE>
0

> <SMILES>
CO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N)ncnc12

> <INCHI>
InChI=1S/C11H15N5O4/c1-19-8-7(18)5(2-17)20-11(8)16-4-15-6-9(12)13-3-14-10(6)16/h3-5,7-8,11,17-18H,2H2,1H3,(H2,12,13,14)/t5-,7-,8-,11-/m1/s1

> <INCHIKEY>
FPUGCISOLXNPPC-IOSLPCCCSA-N

> <CAS_REGISTRY_NUMBER>
2140-79-6

> <REAXYS_REGISTRY_NUMBER>
42301

> <CHEMIDPLUS>
2140-79-6

> <PUBMED_CITATION>
21848266

$$$$