Pahutoxin; (ξ)-form, O-De-Ac
AlkaPlorer ID: AK309183
Synonym: None
IUPAC Name: None
Structure
SMILES: CCCCCCCCCCCCCC(O)CC(=O)OCC[N+](C)(C)C
InChI: InChI=1S/C21H44NO3/c1-5-6-7-8-9-10-11-12-13-14-15-16-20(23)19-21(24)25-18-17-22(2,3)4/h20,23H,5-19H2,1-4H3/q+1
InChIKey: YPEOWEMPEGURCB-UHFFFAOYSA-N
Reference
CAS: 116613-93-5
Source
Properties Information
Molecule Weight: 358.5870000000001
TPSA?: 46.53
MolLogP?: 4.687900000000004
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
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