Basic information
- CAS
23315-05-1- Standard SMILES
CCCCCC/C=C\[N+]([O-])=N[C@@H](COC)[C@H](C)O- InChIKey
BCPWSYQGYBTINM-ZABQTCLWSA-N- Molecular formula
- C13H26N2O3
- Average molar mass
- 258.36 g/mol
- Monoisotopic mass
- 258.1943427
Overview
Elaiomycin is an azoxy compound.
Names & identifiers
- Preferred name
- Elaiomycin
- IUPAC
- [(2S,3S)-3-hydroxy-1-methoxybutan-2-yl]imino-[(Z)-oct-1-enyl]-oxidoazanium
Names & synonyms
ELAIOMYCIN227V1PL5TFD-threo-4-Methoxy-3-(1-octenylazoxy)-2-butanolD-threo-Methoxy-3-(1-octenyl-ONN-azoxy)-2-butanol2-Butanol, 4-methoxy-3-(1-octenyl-ONN-azoxy)-, D-threo-2-Butanol, 4-methoxy-3-(1-octenyl-ONN-azoxy)-, (E,Z)-(2S,3S)-23315-05-12-Butanol, 4-methoxy-1((N(E),1Z)-1-octenyl-ONN-azoxy)-, (2S,3S)-UNII-227V1PL5TFNSC-88205HSDB 5122NSC 88205
Show more names
BRN 2417343ELAIOMYCIN [MI]ELAIOMYCIN, (+)-CHEMBL2152468SCHEMBL16431330ACon1_001844CHEBI:226447(2S,3S)-4-Methoxy-3-(1'-cis-octenyl-cis-azoxy)-2-butanol
Database identifiers
- CAS
23315-05-1- PubChem CID
- 20054902
- DTXSID
DTXSID801028152- ChEMBL
CHEMBL2152468- ChEBI
CHEBI:226447- UNII
- 227V1PL5TF
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 70.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 255
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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