UNPD186271
AlkaPlorer ID: AK361050
Synonym: None
IUPAC Name: (1E)-1-(1-methylpyrrolidin-2-ylidene)propan-2-one
Structure
SMILES: CC(=O)/C=C1\CCCN1C
InChI: InChI=1S/C8H13NO/c1-7(10)6-8-4-3-5-9(8)2/h6H,3-5H2,1-2H3/b8-6+
InChIKey: CXSJAGTXTKECJV-SOFGYWHQSA-N
Reference
Alkaloids of Erythroxylum lucidum stem-bark
PubChem CID: 12758234
CAS: 39178-30-8
LOTUS: LTS0068965
SuperNatural Ⅲ: SN0058437-01
Source
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Properties Information
Molecule Weight: 139.198
TPSA？: 20.31
MolLogP？: 1.1849
Number of H-Donors: 0
Number of H-Acceptors: 2
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
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