Basic information
- Standard SMILES
CCCCCCCC(=O)OCC(COC(=O)CCCCCCC)OCn1cnc2c(=O)[nH]c(NC(c3ccccc3)(c3ccccc3)c3ccc(OC)cc3)nc21.N#N- InChIKey
YIQNAIDSQHSTEE-UHFFFAOYSA-N- Molecular formula
- C45H57N7O7
- Average molar mass
- 808 g/mol
Names & identifiers
- Preferred name
- N2 (4-methoxyphenyldiphenylmethyl)-9-(1,3-din-octanoyloxy-2-propoxymethyl)guanine
- IUPAC
- [2-[[2-[[(4-methoxyphenyl)-diphenylmethyl]amino]-6-oxo-1H-purin-9-yl]methoxy]-3-octanoyloxypropyl] octanoate;molecular nitrogen
Names & synonyms
YIQNAIDSQHSTEE-UHFFFAOYSA-NN2 (4-methoxyphenyldiphenylmethyl)-9-(1,3-di-n-octanoyloxy-2-propoxymethyl)guanineN2 (4-methoxyphenyldiphenylmethyl)-9-(1,3-din-octanoyloxy-2-propoxymethyl)guanine
Database identifiers
- PubChem CID
- 136332157
Properties
Computed structural properties
- Topological polar surface area
- 190 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 27
- Heavy atoms
- 59
- Formal charge
- 0
- Complexity
- 1,190
Related reactions
6 records
Compound notes
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