SSI

[(3S)-4-hydroxy-3-{[(4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]amino}butyl]phosphonic acid



Chemical Component Summary

Name[(3S)-4-hydroxy-3-{[(4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]amino}butyl]phosphonic acid
SynonymsS-SerMe-ImmH phosphonate
Identifiers[(3S)-4-hydroxy-3-[(4-oxo-3,5-dihydropyrrolo[3,2-d]pyrimidin-7-yl)methylamino]butyl]phosphonic acid
FormulaC11 H17 N4 O5 P
Molecular Weight316.25
TypeNON-POLYMER
Isomeric SMILESc1c(c2c([nH]1)C(=O)NC=N2)CN[C@@H](CCP(=O)(O)O)CO
InChIInChI=1S/C11H17N4O5P/c16-5-8(1-2-21(18,19)20)12-3-7-4-13-10-9(7)14-6-15-11(10)17/h4,6,8,12-13,16H,1-3,5H2,(H,14,15,17)(H2,18,19,20)/t8-/m0/s1
InChIKeyYYXVNWBGVIIBOW-QMMMGPOBSA-N

Chemical Details

Formal Charge0
Atom Count38
Chiral Atom Count1
Bond Count39
Aromatic Bond Count5

Related Resource References

Resource NameReference
Pharos CHEMBL2414636
PubChem 53364404, 135566536
ChEMBL CHEMBL2414636