Basic information
- Standard SMILES
CC(Cc1c[nH]c2ccccc12)(NC(=O)OC1C2CC3CC(C2)CC1C3)C(=O)O- InChIKey
YIZVMHAJBRHEKF-UHFFFAOYSA-N- Molecular formula
- C23H28N2O4
- Average molar mass
- 396.5 g/mol
Names & identifiers
- Preferred name
- 2-adamantyloxycarbonyl-alpha-methyl-DL-tryptophan
- IUPAC
- 2-(2-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)-2-methylpropanoic acid
Names & synonyms
SCHEMBL8700832YIZVMHAJBRHEKF-UHFFFAOYSA-N2-adamantyloxycarbonyl-alpha-methyl-DL-tryptophan2-adamantyl-oxycarbonyl-alpha-methyl-DL-tryptophan2-adamantyloxycarbonyl-alpha- methyl-DL-tryptophan2-adamantyl oxycarbonyl-alpha-methyl DL tryptophane
Database identifiers
- PubChem CID
- 14802503
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 91.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 639
Related reactions
56 records
Linked notes
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