10-Ethyl-1-hydroxy-14-methyl-3-(4-methyl-5-oxooxolan-2-yl)-12-oxa-4-azatetracyclo[7.6.1.04,16.011,15]hexadec-9(16)-en-13-one
Basic information
- Standard SMILES
CCC1C2=C3N(CCCC2)C(C2CC(C)C(=O)O2)CC3(O)C2C(C)C(=O)OC12- InChIKey
NRAYVMDGNDSGJU-UHFFFAOYSA-N- Molecular formula
- C22H31NO5
- Average molar mass
- 389.5 g/mol
- Monoisotopic mass
- 389.22022309
Overview
10-Ethyl-1-hydroxy-14-methyl-3-(4-methyl-5-oxooxolan-2-yl)-12-oxa-4-azatetracyclo[7.6.1.04,16.011,15]hexadec-9(16)-en-13-one has been reported in Stemona japonica with data available.
Names & identifiers
- Preferred name
- 10-Ethyl-1-hydroxy-14-methyl-3-(4-methyl-5-oxooxolan-2-yl)-12-oxa-4-azatetracyclo[7.6.1.04,16.011,15]hexadec-9(16)-en-13-one
- IUPAC
- 10-ethyl-1-hydroxy-14-methyl-3-(4-methyl-5-oxooxolan-2-yl)-12-oxa-4-azatetracyclo[7.6.1.04,16.011,15]hexadec-9(16)-en-13-one
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 76.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 747
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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