Basic information
- CAS
130469-38-4- Standard SMILES
Nc1ncnc2c1ncn2[C@H]1C[C@H](CO)[C@@H](CO)O1- InChIKey
ROKFTZONUGKALY-BWZBUEFSSA-N- Molecular formula
- C11H15N5O3
- Average molar mass
- 265.27 g/mol
- Monoisotopic mass
- 265.11748936
Names & identifiers
- Preferred name
- Adenosine, 2',3'-dideoxy-3'-(hydroxymethyl)
- IUPAC
- [(2S,3R,5R)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolan-3-yl]methanol
Names & synonyms
130469-38-43'-Hydroxymethyl-DDA6NH2-3'CH2OHriboddPAdenosine, 2',3'-dideoxy-3'-(hydroxymethyl)2',3'-Dideoxy-3'-hydroxymethyl adenosineNSC 628989DTXSID101565679-(2',3'-Dideoxy-3'-C-(hydroxymethyl)-beta-D-erythro-pentofuranosyl)adenineRefChem:317264DTXCID5079058((2S,3R,5R)-5-(6-Amino-9H-purin-9-yl)tetrahydrofuran-2,3-diyl)dimethanolNSC628989
Show more names
[(2S,3R,5R)-5-(6-amino-9H-purin-9-yl)-2-(hydroxymethyl)oxolan-3-yl]methanolAdenosine,2',3'-dideoxy-3'-(hydroxymethyl)- (9CI)CHEMBL3245672',3'-Dideoxy-3'-(hydroxymethyl)adenosine6-Amino-9-[2,3-dideoxy-3-hydroxymethyl-.beta.-D-ribofuranosyl]-9H-purine-9-[2',3'-Dideoxy-3'-C-(hydroxymethyl)-.beta.-D-erythro-pentofuranosyl]adenine[(2S,3R,5R)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-yl]methanol
Database identifiers
- CAS
130469-38-4- PubChem CID
- 451817
- DTXSID
DTXSID10156567- ChEMBL
CHEMBL324567- Nikkaji
- J360.957J
Properties
Computed structural properties
- XLogP
- -1
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 321
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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