Epoxyseneciphylline
Basic information
- CAS
95723-62-9- Standard SMILES
C/C=C1/CC2(CO2)C(C)(O)C(=O)OCC2=CCN3CCC(OC1=O)C23- InChIKey
GIZHBBIDFVTESC-JYOAFUTRSA-N- Molecular formula
- C18H23NO6
- Average molar mass
- 349.4 g/mol
- Monoisotopic mass
- 349.15253745
Names & identifiers
- Preferred name
- Epoxyseneciphylline
- IUPAC
- (4Z)-4-ethylidene-7-hydroxy-7-methylspiro[2,9-dioxa-14-azatricyclo[9.5.1.014,17]heptadec-11-ene-6,2'-oxirane]-3,8-dione
Names & synonyms
Epoxyseneciphylline95723-62-9CCRIS 5778(13-alpha)-13,19-Epoxy-12-hydroxysenecionan-11,16-dioneSenecionan-11,16-dione, 13,19-epoxy-12-hydroxy-, (13-alpha)-
Database identifiers
- CAS
95723-62-9- PubChem CID
- 6440923
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 88.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 0
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 685
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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