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Details

Stereochemistry ABSOLUTE
Molecular Formula C10H13N4O9P
Molecular Weight 364.2054
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of XANTHOSINE 5'-MONOPHOSPHATE

SMILES

O[C@@H]1[C@@H](COP(O)(O)=O)O[C@H]([C@@H]1O)N2C=NC3=C2NC(=O)NC3=O

InChI

InChIKey=DCTLYFZHFGENCW-UUOKFMHZSA-N
InChI=1S/C10H13N4O9P/c15-5-3(1-22-24(19,20)21)23-9(6(5)16)14-2-11-4-7(14)12-10(18)13-8(4)17/h2-3,5-6,9,15-16H,1H2,(H2,19,20,21)(H2,12,13,17,18)/t3-,5-,6-,9-/m1/s1

HIDE SMILES / InChI

Molecular Formula C10H13N4O9P
Molecular Weight 364.2054
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
Y29K672ETF
Record Status Validated (UNII)
Record Version