QUG

2-amino-5-({[(1S,4S,5S)-4,5-dihydroxycyclopent-2-en-1-yl]amino}methyl)-1,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one


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Chemical Component Summary

Name2-amino-5-({[(1S,4S,5S)-4,5-dihydroxycyclopent-2-en-1-yl]amino}methyl)-1,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one
SynonymsQueuine
Identifiers2-azanyl-5-[[[(1~{S},4~{S},5~{S})-4,5-bis(oxidanyl)cyclopent-2-en-1-yl]amino]methyl]-1,7-dihydropyrrolo[2,3-d]pyrimidin-4-one
FormulaC12 H15 N5 O3
Molecular Weight277.279
TypeNON-POLYMER
Isomeric SMILESc1c(c2c([nH]1)NC(=NC2=O)N)CN[C@H]3C=C[C@@H]([C@H]3O)O
InChIInChI=1S/C12H15N5O3/c13-12-16-10-8(11(20)17-12)5(4-15-10)3-14-6-1-2-7(18)9(6)19/h1-2,4,6-7,9,14,18-19H,3H2,(H4,13,15,16,17,20)/t6-,7-,9-/m0/s1
InChIKeyWYROLENTHWJFLR-ZKWXMUAHSA-N

Chemical Details

Formal Charge0
Atom Count35
Chiral Atom Count3
Bond Count37
Aromatic Bond Count5

Related Resource References

Resource NameReference
PubChem 145946130