Basic information
- Standard SMILES
C=C[C@@H](COC)N(CC(O)C(=C)C(=O)OC)C(=O)OC(C)(C)C- InChIKey
BHVWTTPWEBVNEI-UEWDXFNNSA-N- Molecular formula
- C16H27NO6
- Average molar mass
- 329.39 g/mol
Names & identifiers
- Preferred name
- methyl 4-(tert-butoxycarbonyl((S)-1-methoxybut-3-en-2-yl)amino)-3-hydroxy-2-methylenebutanoate
- IUPAC
- methyl 3-hydroxy-4-[[(2S)-1-methoxybut-3-en-2-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]-2-methylidenebutanoate
Names & synonyms
SCHEMBL15318899BHVWTTPWEBVNEI-UEWDXFNNSA-Nmethyl 4-(tert-butoxycarbonyl((S)-1-methoxybut-3-en-2-yl)amino)-3-hydroxy-2-methylenebutanoate
Database identifiers
- PubChem CID
- 89851376
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 85.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 11
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 440
Related reactions
2 records
Compound notes
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