Basic information
- Standard SMILES
COC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C- InChIKey
VURIGNDVTSFLOU-JTQLQIEISA-N- Molecular formula
- C15H21NO6
- Average molar mass
- 311.33 g/mol
Names & identifiers
- Preferred name
- (S)-Methyl 2-((tert-butoxycarbonyl)amino)-3-(3,4-dihydroxyphenyl)propanoate
- IUPAC
- methyl (2S)-3-(3,4-dihydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate
Names & synonyms
(S)-Methyl 2-((tert-butoxycarbonyl)amino)-3-(3,4-dihydroxyphenyl)propanoate37169-36-1MFCD20260285methyl (2S)-3-(3,4-dihydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoateN-Boc-3-Hydroxy-L-Tyrosine methyl esterSCHEMBL3013717VURIGNDVTSFLOU-JTQLQIEISA-NN-(tert-butoxycarbonyl)-3,4-dihydroxy-L-phenylalanine methyl esterAKOS024464808CS-W021178DS-8352HY-W040438
Show more names
PD197113SY103790DB-200586W11489F463757Methyl (S)-2-(Boc-amino)-3-(3,4-dihydroxyphenyl)propanoate(S)-Methyl2-((tert-butoxycarbonyl)amino)-3-(3,4-dihydroxyphenyl)propanoatemethyl (2S)-2-(tert-butoxycarbonylamino)-3-(3,4-dihydroxyphenyl)propanoate
Database identifiers
- PubChem CID
- 14889488
- Nikkaji
- J1.136.953G
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 392
Related reactions
2 records
Compound notes
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