C1CCC(CC1)C2(C(C(C(O2)CO)O)O)N3C=NC4=C(N=CN=C43)N
الاسم: (2R,3R,4S,5R)-2-(6-aminopurin-9-yl)-2-cyclohexyl-5-(hydroxymethyl)oxolane-3,4-diol
SMILES: C1CCC(CC1)C2(C(C(C(O2)CO)O)O)N3C=NC4=C(N=CN=C43)N

Molecular Processing

Molecular formula
C16H23N5O4
Molecular weight
349.39
Exact mass
349.175
XLogP
-0.25
TPSA
139.54
H-bond donors
4
H-bond acceptors
8
Rotatable bonds
3
Heavy atoms
25
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.688
Molar refractivity
88.26

Supplementary Information

InChIKey: CHMUHOFITZIING-XNIJJKJLSA-N
مرادفات
cyclohexyladenosinecyclohexyl-adenosinecyclohexyl-(3h)adenosineSCHEMBL120561CHEBI:232101CHMUHOFITZIING-XNIJJKJLSA-N
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