Basic information
- CAS
105970-04-5- Standard SMILES
C=C1CC(C)(Cn2c(N)nc3nc[nH]c3c2=O)OC1=O- InChIKey
WJSVJNDMOQTICG-UHFFFAOYSA-N- Molecular formula
- C12H13N5O3
- Average molar mass
- 275.26 g/mol
- Monoisotopic mass
- 275.10183929
Overview
RN & structure given in first source; RN not in Chemline 4/87
Names & identifiers
- Preferred name
- 1-((2-Methyl-5-methylene-5-oxotetrahydrofuran-2-yl)methyl)guanine
- IUPAC
- 2-amino-1-[(2-methyl-4-methylidene-5-oxooxolan-2-yl)methyl]-7H-purin-6-one
- English name
- 1-Mmofg
- Molecular formula
- C12H13N5O3
- Molecular weight
- 275.26332
Names & synonyms
1-Mmofg105970-04-51-((2-Methyl-5-methylene-5-oxotetrahydrofuran-2-yl)methyl)guanineRefChem:73836NSC606496Guanine derivative5'-Methyl-5'-(guanin-1-ylmethyl)-2'-oxo-3'-methylene- tetrahydrofuranCHEMBL155013DTXSID20909844NSC-6064962-Imino-1-((2-methyl-4-methylene-5-oxotetrahydro-2-furanyl)methyl)-1,2,3,9-tetrahydro-6H-purin-6-one2-imino-1-[(2-methyl-4-methylene-5-oxo-tetrahydrofuran-2-yl)methyl]-3,9-dihydropurin-6-one
Show more names
2-Imino-1-[(2-methyl-4-methylidene-5-oxooxolan-2-yl)methyl]-1,2,3,9-tetrahydro-6H-purin-6-one6H-Purin-6-one, 2-amino-1,7-dihydro-1-((tetrahydro-2-methyl-4-methylene-5-oxo-2-furanyl)methyl)-
Database identifiers
- CAS
105970-04-5- PubChem CID
- 129161
- DTXSID
DTXSID20909844- ChEMBL
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 531
Chemistry & industry
Suppliers2 total
HONEST JOY HOLDINGS LIMITED[email protected]
CHEMICAL LAND21[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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