Basic information
- CAS
73326-88-2- Standard SMILES
C[C@@H]1CC[C@@H](C(C)(C)NCCc2c[nH]c3ccccc23)CC1=O- InChIKey
YKGQTGZOJCRHNO-GDBMZVCRSA-N- Molecular formula
- C20H28N2O
- Average molar mass
- 312.4 g/mol
- Monoisotopic mass
- 312.22016352
Overview
Fruticosonine is a member of tryptamines.
Names & identifiers
- Preferred name
- Fruticosonine
- IUPAC
- trans-(2R,5R)-5-[2-[2-(1H-indol-3-yl)ethylamino]propan-2-yl]-2-methylcyclohexan-1-one
Names & synonyms
Fruticosonine73326-88-2C09191(2R,5R)-5-[2-[2-(1H-indol-3-yl)ethylamino]propan-2-yl]-2-methylcyclohexan-1-oneAC1L9C8KCHEBI:5178DTXSID10331736(2R,5R)-5-(2-{[2-(1H-indol-3-yl)ethyl]amino}propan-2-yl)-2-methylcyclohexan-1-oneQ27106678
Database identifiers
- CAS
73326-88-2- PubChem CID
- 442091
- DTXSID
DTXSID10331736- ChEBI
CHEBI:5178- Nikkaji
- J2.768.903E
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 44.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 420
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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