Basic information
- CAS
123072-45-7- Standard SMILES
O=C(NCCCNC(=O)[C@H](OS(=O)(=O)[O-])[C@@H](OS(=O)(=O)[O-])[C@H](O[C@@H]1O[C@H](COS(=O)(=O)[O-])[C@H](OS(=O)(=O)[O-])[C@H](OS(=O)(=O)[O-])[C@H]1OS(=O)(=O)[O-])[C@@H](COS(=O)(=O)[O-])OS(=O)(=O)[O-])[C@H](OS(=O)(=O)[O-])[C@@H](OS(=O)(=O)[O-])[C@H](O[C@@H]1O[C@H](COS(=O)(=O)[O-])[C@H](OS(=O)(=O)[O-])[C@H](OS(=O)(=O)[O-])[C@H]1OS(=O)(=O)[O-])[C@@H](COS(=O)(=O)[O-])OS(=O)(=O)[O-].[Na].[Na].[Na].[Na].[Na].[Na].[Na].[Na].[Na].[Na].[Na].[Na].[Na].[Na].[Na].[Na]- InChIKey
NUYAZTAMFJQDNB-HPXJARCXSA-A- Molecular formula
- C27H34N2Na16O70S16-16
- Average molar mass
- 2,387.4 g/mol
- Monoisotopic mass
- 2,385.3056697
Names & identifiers
- Preferred name
- CID 138395103
Names & synonyms
DTXSID90904508
Database identifiers
- CAS
123072-45-7- PubChem CID
- 138395103
- DTXSID
DTXSID90904508
Properties
Computed structural properties
- Topological polar surface area
- 1,290 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 70
- Rotatable bonds
- 36
- Heavy atoms
- 131
- Formal charge
- -16
- Complexity
- 4,720
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…