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5'-chloro-5'-deoxyadenosine

Properties

Image

Occurences in reactions

MNX_ID

MNXM4378

	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	0

formula

C₁₀H₁₂ClN₅O₃

charge

mass

285.688

reference

InChIKey

IYSNPOMTKFZDHZ-KQYNXXCUSA-N

InChI

InChI=1S/C10H12ClN5O3/c11-1-4-6(17)7(18)10(19-4)16-3-15-5-8(12)13-2-14-9(5)16/h2-4,6-7,10,17-18H,1H2,(H2,12,13,14)/t4-,6-,7-,10-/m1/s1

SMILES

[CH2:1]([C@@H:4]1[C@@H:6]([OH:17])[C@@H:7]([OH:18])[C@H:10]([n:16]2[cH:3][n:15][c:5]3[c:8]([NH2:12])[n:13][cH:2][n:14][c:9]32)[O:19]1)[Cl:11]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:47133 chebi:47133	5'-chloro-5'-deoxyadenosine 5'-CHLORO-5'-DEOXYADENOSINE 5'-chloroadenosine
sabiork.compound:28247 sabiorkM:28247	5'-Chloro-5'-deoxyadenosine
metacyc.compound:CPD-12676 metacycM:CPD-12676	5'-chloro-5'-deoxyadenosine 5'-CIDA 5'-deoxy-5'-chloroadenosine
kegg.compound:C19768 keggC:C19768	5-Deoxy-5-chloroadenosine
seed.compound:cpd21014 seedM:cpd21014	5-Deoxy-5-chloroadenosine 5'-CIDA 5'-chloro-5'-deoxyadenosine 5'-deoxy-5'-chloroadenosine
keggC:M_C19768 seedM:M_cpd21014	secondary/obsolete/fantasy identifier