Histrionicotoxins; Histrionicotoxin 285B

AlkaPlorer ID: AK300519

Synonym: Neodihydrohistrionicotoxin, HTX-285B, Dendrobates Alkaloid 285B 

IUPAC Name: None

Structure

SMILES: C#C/C=C/CC1CCCC2(CCCC(O)C2/C=C/C=C)N1

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InChI: InChI=1S/C19H27NO/c1-3-5-7-10-16-11-8-14-19(20-16)15-9-13-18(21)17(19)12-6-4-2/h1,4-7,12,16-18,20-21H,2,8-11,13-15H2/b7-5+,12-6+

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InChIKey: FQIWPVJJYOOITJ-YTEPGLGFSA-N

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Reference

CAS: 55475-52-0

Properties Information

Molecule Weight: 285.43100000000004

TPSA: 32.26

MolLogP: 3.3500000000000014

Number of H-Donors: 2

Number of H-Acceptors: 2

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information