1-(1,2-hydroquinone)-N-acetyltryptophan
Basic information
- CAS
106078-47-1- Standard SMILES
CC(=O)N[C@@H](Cc1cn(-c2ccc(O)c(O)c2)c2ccccc12)C(=O)O.Cl- InChIKey
OZNRUEHBJVKZPR-RSAXXLAASA-N- Molecular formula
- C19H19ClN2O5
- Average molar mass
- 390.8 g/mol
- Monoisotopic mass
- 390.0982494
Overview
structure given in first source
Names & identifiers
- Preferred name
- 1-(1,2-hydroquinone)-N-acetyltryptophan
- IUPAC
- (2S)-2-acetamido-3-[1-(3,4-dihydroxyphenyl)indol-3-yl]propanoic acid;hydrochloride
- English name
- 1-(1,2-hydroquinone)-N-acetyltryptophan
- Molecular formula
- C19H19ClN2O5
- Molecular weight
- 390.82
Names & synonyms
1-Hatp1-(1,2-Hydroquinone)-N-acetyltryptophan106078-47-1DTXSID60147501RefChem:73870DTXCID7069992N-Acetyl-1-(3,4-dihydroxyphenyl)-L-tryptophan--hydrogen chloride (1/1)
Database identifiers
- CAS
106078-47-1- PubChem CID
- 129180
- DTXSID
DTXSID60147501
Properties
Computed structural properties
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 528
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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