Chem
J-GLOBAL ID:200907084797803404
Nikkaji number:J817.036C
Adenosine 3′-phosphoric acid 5′-diphosphoric acid
アデノシン3′-りん酸5′-二りん酸
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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:
C10 H16 N5 O13 P3
Molecular formula furigana:
C10-H16-N5-O13-P3
Molecular weight:
507.181
InChI:
InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-6(16)7(27-29(17,18)19)4(26-10)1-25-31(23,24)28-30(20,21)22/h2-4,6-7,10,16H,1H2,(H,23,24)(H2,11,12,13)(H2,17,18,19)(H2,20,21,22)/t4-,6-,7-,10-/m1/s1
InChI key:
GBBWIZKLHXYJOA-KQYNXXCUSA-N
SMILES:
Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1O
Systematic name (3):
アデノシン3′-りん酸5′-二りん酸
[({[(2R,3S,4R,5R)-5-(6-アミノ-9H-プリン-9-イル)-4-ヒドロキシ-3-(ホスホノオキシ)オキソラン-2-イル]メトキシ}(ヒドロキシ)ホスホリル)オキシ]ホスホン酸
[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]phosphonic acid
Other name (1):
Adenosine 3′-phosphoric acid 5′-diphosphoric acid
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