Basic information
- CAS
18546-02-6- Standard SMILES
C[C@@H](O)[C@@H](O)[C@@H](O)[C@H](O)C=O- InChIKey
PNNNRSAQSRJVSB-KAZBKCHUSA-N- Molecular formula
- C6H12O5
- Average molar mass
- 164.16 g/mol
- Monoisotopic mass
- 164.06847348
Overview
RN given is for 6-deoxy-D-altrose; RN for parent cpd not in Chemline 11/93; Yersinia enterocolitica O antigen is a homopolymer of 6-deoxy-L-altrose
Names & identifiers
- Preferred name
- 6-Deoxyaltrose
- IUPAC
- (2S,3R,4R,5R)-2,3,4,5-tetrahydroxyhexanal
- English name
- 6-deoxyaltrose
- Molecular formula
- C6H12O5
- Molecular weight
- 164.16
Names & synonyms
6-Deoxyaltrose18546-02-6DTXSID20171781RefChem:104535GlyTouCan:G70895DHDTXCID1094272CHEBI:155839G70895DH(2S,3R,4R,5R)-2,3,4,5-tetrahydroxyhexanal6-DEOXY-D-ALTROSED-Altrose, 6-deoxy-SCHEMBL1458729
Show more names
6-Deoxy-L-altrose
Database identifiers
- CAS
18546-02-6- PubChem CID
- 152241
- DTXSID
DTXSID20171781- Nikkaji
- J2.367.193J
Properties
Computed structural properties
- XLogP
- -2.4
- Topological polar surface area
- 98 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 126
Physicochemical properties
- Boiling point
- 399.09 · 399.090±35.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.41 · 1.410±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 12.5 · 12.500±0.20(predicted)
Chemistry & industry
Suppliers1 total
宝欧信特生物科技（苏州）有限公司51288865780 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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