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60102-37-6

60102-37-6 Structure

60102-37-6 Structure
IdentificationBack Directory
[Name]

Petasitenine
[CAS]

60102-37-6
[Synonyms]

C10359
Petasitenine
PETASITINENE
Fukinotoxin【neutral】
Petasitenine【neutral】
(15R,20R)-15,20-Epoxy-15,20-dihydro-12-hydroxy-4-methyl-4,8-secosenecionan-8,11,16-trione
Spiro[2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-4,2'-oxirane]-3,8,17-trione, 7-hydroxy-3',6,7,14-tetramethyl-, (1R,2'R,3'R,6R,7R)-
[Molecular Formula]

C19H27NO7
[MDL Number]

MFCD01708830
[MOL File]

60102-37-6.mol
[Molecular Weight]

381.42
Chemical PropertiesBack Directory
[Melting point ]

129.5°C
[Boiling point ]

508.82°C (rough estimate)
[density ]

1.2977 (rough estimate)
[refractive index ]

1.5180 (estimate)
[pka]

12.75±0.60(Predicted)
[color ]

Crystals from C6H6/hexane or Me2CO
[IARC]

3 (Vol. 31, Sup 7) 1987
Safety DataBack Directory
[RIDADR ]

1544
[HazardClass ]

6.1(b)
[PackingGroup ]

III
[Toxicity]

mma-sat 1 mg/plate MUREAV 68,211,79
Hazard InformationBack Directory
[Description]

A pyrrolizidine alkaloid, petasitenine occurs, together with neopetasitenine (q.v.) in Petasites japonicus Maxim. Like the accompanying base, it possesses strong hepatotoxic properties.
[Definition]

ChEBI: Petasitenine is a spiro-epoxide.
[Safety Profile]

Questionable carcinogen with experimental carcinogenic data.Mutation data reported. Used as a food and herbal remedy. When heated to decomposition it emits toxic fumes of NOx.
[References]

Yamada etal., Chem.Lett.,461 (1976)
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