Chemical Component Summary

Name{2-[(3S)-3-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)pyrrolidin-1-yl]-2-oxoethyl}phosphonic acid
Identifiers[2-[(3S)-3-(2-azanyl-6-oxidanylidene-1H-purin-9-yl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]phosphonic acid
FormulaC11 H15 N6 O5 P
Molecular Weight342.248
TypeNON-POLYMER
Isomeric SMILESc1nc2c(n1[C@H]3CCN(C3)C(=O)CP(=O)(O)O)N=C(NC2=O)N
InChIInChI=1S/C11H15N6O5P/c12-11-14-9-8(10(19)15-11)13-5-17(9)6-1-2-16(3-6)7(18)4-23(20,21)22/h5-6H,1-4H2,(H2,20,21,22)(H3,12,14,15,19)/t6-/m0/s1
InChIKeyDPSMTUGMQGDYNX-LURJTMIESA-N

Chemical Details

Formal Charge0
Atom Count38
Chiral Atom Count1
Bond Count40
Aromatic Bond Count5

Related Resource References

Resource NameReference
PubChem 135566814, 73293570
ChEMBL CHEMBL2420976