0Y0

5'-{[(3S)-3-amino-3-carboxypropyl]amino}-5'-deoxyadenosine


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Chemical Component Summary

Name5'-{[(3S)-3-amino-3-carboxypropyl]amino}-5'-deoxyadenosine
Identifiers(2S)-4-[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methylamino]-2-azanyl-butanoic acid
FormulaC14 H21 N7 O5
Molecular Weight367.36
TypeNON-POLYMER
Isomeric SMILESc1nc(c2c(n1)n(cn2)[C@H]3[C@@H]([C@@H]([C@H](O3)CNCC[C@@H](C(=O)O)N)O)O)N
InChIInChI=1S/C14H21N7O5/c15-6(14(24)25)1-2-17-3-7-9(22)10(23)13(26-7)21-5-20-8-11(16)18-4-19-12(8)21/h4-7,9-10,13,17,22-23H,1-3,15H2,(H,24,25)(H2,16,18,19)/t6-,7+,9+,10+,13+/m0/s1
InChIKeyWSOGVCAFRBSBRE-WFMPWKQPSA-N

Chemical Details

Formal Charge0
Atom Count47
Chiral Atom Count5
Bond Count49
Aromatic Bond Count10

Related Resource References

Resource NameReference
PubChem 70685469
ChEMBL CHEMBL2018849