Chem
J-GLOBAL ID:200907042173390780
Nikkaji number:J2.586.399B
(14 C)IMP
9-(5-O-ホスホノ-β-D-リボフラノシル)(8-14 C)-9H-プリン-6(1H)-オン
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C9 [14 C]H13 N4 O8 P
Molecular formula furigana:
C10-H13-N4-O8-P
Molecular weight:
350.200
InChI:
InChI=1S/C10H13N4O8P/c15-6-4(1-21-23(18,19)20)22-10(7(6)16)14-3-13-5-8(14)11-2-12-9(5)17/h2-4,6-7,10,15-16H,1H2,(H,11,12,17)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1/i3+2
InChI key:
GRSZFWQUAKGDAV-USSWDBROSA-N
SMILES:
O[C@@H]1[C@@H](COP(=O)(O)O)O[C@H]([C@@H]1O)n1[14cH]nc2c1nc[nH]c2=O
Systematic name (3):
9-(5-O-ホスホノ-β-D-リボフラノシル)(8-14 C)-9H-プリン-6(1H)-オン
{[(2R,3S,4R,5R)-3,4-ジヒドロキシ-5-[6-オキソ-6,9-ジヒドロ(8-14 C)-1H-プリン-9-イル]オキソラン-2-イル]メトキシ}ホスホン酸
{[(2R,3S,4R,5R)-3,4-dihydroxy-5-[6-oxo-6,9-dihydro(8-14 C)-1H-purin-9-yl]oxolan-2-yl]methoxy}phosphonic acid
Other name (2):
9-(5-O-Phosphono-β-D-ribofuranosyl)(8-14 C)-9H-purine-6(1H)-one
(14 C)IMP
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