Chem
J-GLOBAL ID:200907032048734234
Nikkaji number:J413.561J
Thiol ITP
チオールITP
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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 H15 N4 O13 P3 S
Molecular formula furigana:
C10-H15-N4-O13-P3-S
Molecular weight:
524.230
InChI:
InChI=1S/C10H15N4O13P3S/c15-6-4(1-24-29(20,21)27-30(22,23)26-28(17,18)19)25-10(7(6)16)14-3-13-5-8(14)11-2-12-9(5)31/h2-4,6-7,10,15-16H,1H2,(H,20,21)(H,22,23)(H,11,12,31)(H2,17,18,19)/t4-,6-,7-,10-/m1/s1
InChI key:
GQNRDWAOABGWGP-KQYNXXCUSA-N
SMILES:
O[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O[C@H]([C@@H]1O)n1cnc2c(S)ncnc12
Systematic name (6):
1-(6-メルカプト-9H-プリン-9-イル)-1-デオキシ-β-D-リボフラノース5-三りん酸
1-デオキシ-1-(6-メルカプト-9H-プリン-9-イル)-β-D-リボフラノース5-三りん酸
6-チオイノシン5′-三りん酸
6-チオイノシン5′-トリホスファート
({[({[(2R,3S,4R,5R)-3,4-ジヒドロキシ-5-(6-スルファニル-9H-プリン-9-イル)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](ヒドロキシ)ホスホリル}オキシ)ホスホン酸
({[({[(2R,3S,4R,5R)-3,4-dihydroxy-5-(6-sulfanyl-9H-purin-9-yl)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid
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Other name (8):
CAS registry number:
27652-34-2
Thsaurus map:
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