7-(-)-Trachelanthylplatynecine
Basic information
- Standard SMILES
CC(C)[C@](O)(C(=O)OC1CCN2CCC(CO)C12)[C@H](C)O- InChIKey
VHBFIBCAIUIJQC-CEJAEVFISA-N- Molecular formula
- C15H27NO5
- Average molar mass
- 301.38 g/mol
- Monoisotopic mass
- 301.18892296
Names & identifiers
- Preferred name
- 7-(-)-Trachelanthylplatynecine
- IUPAC
- [7-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl] (2R)-2-hydroxy-2-[(1S)-1-hydroxyethyl]-3-methylbutanoate
Names & synonyms
7-(-)-TrachelanthylplatynecineNSC610331NSC-610331
Database identifiers
- PubChem CID
- 355833
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 90.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 388
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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