Indole, 1-(alpha-L-arabinopyranosyl)-6-nitro-
Basic information
- CAS
67189-84-8- Standard SMILES
O=[N+]([O-])c1ccc2ccn(O[C@@H]3OC[C@@H](O)C(O)C3O)c2c1- InChIKey
XHQAZNRJHYVWQB-XVSSEFHLSA-N- Molecular formula
- C13H14N2O7
- Average molar mass
- 310.26 g/mol
- Monoisotopic mass
- 310.08010079
Names & identifiers
- Preferred name
- Indole, 1-(alpha-L-arabinopyranosyl)-6-nitro-
- IUPAC
- (2S,5R)-2-(6-nitroindol-1-yl)oxyoxane-3,4,5-triol
Names & synonyms
INDOLE, 1-(alpha-L-ARABINOPYRANOSYL)-6-NITRO-67189-84-8RefChem:10873021-alpha-L-Arabinopyranosyl-6-nitroindoleArabinopyranose, 1-(nitroindolyl)-, alpha-L-DTXSID409862136-Nitro-1H-indol-1-yl pentopyranoside6-nitro-1H-indol-1-yl beta-D-glycero-pentopyranoside
Database identifiers
- CAS
67189-84-8- PubChem CID
- 49393
- DTXSID
DTXSID40986213
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 130 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 418
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…