Chem
J-GLOBAL ID:201007029805658613
Nikkaji number:J2.804.101B
6-Thioxanthosine 5′-monophosphate
6-チオキサントシン5′-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 H13 N4 O8 PS
Molecular formula furigana:
C10-H13-N4-O8-P-S
Molecular weight:
380.270
InChI:
InChI=1S/C10H13N4O8PS/c15-5-3(1-21-23(18,19)20)22-9(6(5)16)14-2-11-4-7(14)12-10(17)13-8(4)24/h2-3,5-6,9,15-16H,1H2,(H2,18,19,20)(H2,12,13,17,24)/t3-,5-,6-,9-/m1/s1
InChI key:
WMRIOGFRJLQENF-UUOKFMHZSA-N
SMILES:
O[C@@H]1[C@@H](COP(=O)(O)O)O[C@H]([C@@H]1O)n1cnc2c1[nH]c(=O)[nH]c2=S
Systematic name (3):
6-チオキサントシン5′-りん酸
{[(2R,3S,4R,5R)-3,4-ジヒドロキシ-5-(2-オキソ-6-スルファニリデン-2,3,6,9-テトラヒドロ-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-(2-oxo-6-sulfanylidene-2,3,6,9-tetrahydro-1H-purin-9-yl)oxolan-2-yl]methoxy}phosphonic acid
Other name (2):
6-Thioxanthosine 5′-phosphoric acid
6-Thioxanthosine 5′-monophosphate
CAS registry number:
3237-49-8
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