Chemical Component Summary

Name(1S,2R,3R,5R)-3-(hydroxymethyl)-5-(quinazolin-4-ylamino)cyclopentane-1,2-diol
Identifiers(1S,2R,3R,5R)-3-(hydroxymethyl)-5-(quinazolin-4-ylamino)cyclopentane-1,2-diol
FormulaC14 H17 N3 O3
Molecular Weight275.303
TypeNON-POLYMER
Isomeric SMILESc1ccc2c(c1)c(ncn2)N[C@@H]3C[C@@H]([C@H]([C@H]3O)O)CO
InChIInChI=1S/C14H17N3O3/c18-6-8-5-11(13(20)12(8)19)17-14-9-3-1-2-4-10(9)15-7-16-14/h1-4,7-8,11-13,18-20H,5-6H2,(H,15,16,17)/t8-,11-,12-,13+/m1/s1
InChIKeyCXHFBVLYDOBWST-STRQVWJDSA-N

Chemical Details

Formal Charge0
Atom Count37
Chiral Atom Count4
Bond Count39
Aromatic Bond Count11

Related Resource References

Resource NameReference
PubChem 122172806