Pteleprenine
Basic information
- CAS
17232-50-7- Standard SMILES
COc1c(CC=C(C)C)c(=O)n(C)c2c3c(ccc12)OCO3- InChIKey
VCWHRRGGVPCIEU-UHFFFAOYSA-N- Molecular formula
- C17H19NO4
- Average molar mass
- 301.34 g/mol
- Monoisotopic mass
- 301.13140809
Overview
Pteleprenine has been reported in Haplophyllum bucharicum and Orixa japonica with data available.
Names & identifiers
- Preferred name
- Pteleprenine
- IUPAC
- 6-methoxy-9-methyl-7-(3-methylbut-2-enyl)-[1,3]dioxolo[4,5-h]quinolin-8-one
- English name
- pteleprenine
- Molecular formula
- C17H19NO4
- Molecular weight
- 301.33706
Names & synonyms
Pteleprenine17232-50-76-methoxy-9-methyl-7-(3-methylbut-2-enyl)-[1,3]dioxolo[4,5-h]quinolin-8-oneDTXSID301692556-methoxy-9-methyl-7-(3-methylbut-2-enyl)-(1,3)dioxolo(4,5-h)quinolin-8-oneRefChem:177086DTXCID80917466-Methoxy-9-methyl-7-(3-methylbut-2-en-1-yl)-[1,3]dioxolo[4,5-h]quinolin-8(9H)-one6-Methoxy-9-methyl-7-(3-methylbut-2-en-1-yl)-2H-[1,3]dioxolo[4,5-h]quinolin-8(9H)-one
Database identifiers
- CAS
17232-50-7- PubChem CID
- 167633
- DTXSID
DTXSID30169255- Nikkaji
- J588.190K
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 48 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 521
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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