Pahutoxin; (ξ)-form, O-De-Ac, O-butanoyl 

AlkaPlorer ID: AK309184

Synonym: None

IUPAC Name: None

Structure

SMILES: CCCCCCCCCCCCCC(CC(=O)OCC[N+](C)(C)C)OC(=O)CCC

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InChI: InChI=1S/C25H50NO4/c1-6-8-9-10-11-12-13-14-15-16-17-19-23(30-24(27)18-7-2)22-25(28)29-21-20-26(3,4)5/h23H,6-22H2,1-5H3/q+1

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InChIKey: LIOZLUIZNGWWER-UHFFFAOYSA-N

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Reference

CAS: 116613-95-7

Source

Properties Information

Molecule Weight: 428.6780000000003

TPSA: 52.6

MolLogP: 6.038900000000006

Number of H-Donors: 0

Number of H-Acceptors: 4

RingCount: 0

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information