 Home > Encyclopedia > 6-[(1E,3E,5E)-6-[(2R,3R,3aR,4R,5R,6aS)-5-Ethylhexahydro-3,4-dihydroxy-3a,4-dimethylfuro[2,3-b]furan-2-yl]-1,3,5-hexatrien-1-yl]-4-methoxy-5-methyl-2H-pyran-2-one

6-[(1E,3E,5E)-6-[(2R,3R,3aR,4R,5R,6aS)-5-Ethylhexahydro-3,4-dihydroxy-3a,4-dimethylfuro[2,3-b]furan-2-yl]-1,3,5-hexatrien-1-yl]-4-methoxy-5-methyl-2H-pyran-2-one

6-[(1E,3E,5E)-6-[(2R,3R,3aR,4R,5R,6aS)-5-Ethylhexahydro-3,4-dihydroxy-3a,4-dimethylfuro[2,3-b]furan-2-yl]-1,3,5-hexatrien-1-yl]-4-methoxy-5-methyl-2H-pyran-2-one structure

CAS No:
79663-49-3
Formula:
C23H30O7
Chemical Name:
6-[(1E,3E,5E)-6-[(2R,3R,3aR,4R,5R,6aS)-5-Ethylhexahydro-3,4-dihydroxy-3a,4-dimethylfuro[2,3-b]furan-2-yl]-1,3,5-hexatrien-1-yl]-4-methoxy-5-methyl-2H-pyran-2-one
Synonyms:
2H-Pyran-2-one,6-[(1E,3E,5E)-6-[(2R,3R,3aR,4R,5R,6aS)-5-ethylhexahydro-3,4-dihydroxy-3a,4-dimethylfuro[2,3-b]furan-2-yl]-1,3,5-hexatrien-1-yl]-4-methoxy-5-methyl-;2H-Pyran-2-one,6-[6-(5-ethylhexahydro-3,4-dihydroxy-3a,4-dimethylfuro[2,3-b]furan-2-yl)-1,3,5-hexatrienyl]-4-methoxy-5-methyl-,[2R-[2α(1E,3E,5E),3α,3aβ,4β,5β,6aβ]]-;2H-Pyran-2-one,6-[(1E,3E,5E)-6-[(2R,3R,3aR,4R,5R,6aS)-5-ethylhexahydro-3,4-dihydroxy-3a,4-dimethylfuro[2,3-b]furan-2-yl]-1,3,5-hexatrienyl]-4-methoxy-5-methyl-;6-[(1E,3E,5E)-6-[(2R,3R,3aR,4R,5R,6aS)-5-Ethylhexahydro-3,4-dihydroxy-3a,4-dimethylfuro[2,3-b]furan-2-yl]-1,3,5-hexatrien-1-yl]-4-methoxy-5-methyl-2H-pyran-2-one;Asteltoxin;(+)-Asteltoxin;EV-toxin;16-Methylvarioxiranol L

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Description

Asteltoxin is a furofuran.

6-[(1E,3E,5E)-6-[(2R,3R,3aR,4R,5R,6aS)-5-Ethylhexahydro-3,4-dihydroxy-3a,4-dimethylfuro[2,3-b]furan-2-yl]-1,3,5-hexatrien-1-yl]-4-methoxy-5-methyl-2H-pyran-2-one Basic Attributes

Molecular Weight：

418.486

Exact Mass：

418.48

Characteristics

PSA：

94.4

XLogP3：

2.1

Density：

1.1614 (rough estimate)

Boiling Point：

456.23°C (rough estimate)

Toxicity：

Peritoneal-mouse LD50: 5.9 mg/kg

Flammability characteristics：

Flammable; burning produces irritating fumes

Safety Information

Storage features：

Ventilated, low temperature and dry; stored separately from food materials in warehouse

Toxicity

Toxicity class：

most toxic

Drug Information

MeSH Entry Terms：

asteltoxin

Computed Properties

Molecular Weight:418.5
XLogP3:2.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:418.19915329
Monoisotopic Mass:418.19915329
Topological Polar Surface Area:94.4
Heavy Atom Count:30
Complexity:837
Defined Atom Stereocenter Count:6
Defined Bond Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: 1 chlorobutane; acetic acid formula; ethyl propionate; strem chemicals inc.; calcium nitride; difluoroethane

Guide of 6-[(1E,3E,5E)-6-[(2R,3R,3aR,4R,5R,6aS)-5-Ethylhexahydro-3,4-dihydroxy-3a,4-dimethylfuro[2,3-b]furan-2-yl]-1,3,5-hexatrien-1-yl]-4-methoxy-5-methyl-2H-pyran-2-one

Description
Basic Attributes
Characteristics
Safety Information
Toxicity
Drug Information
Computed Properties

6-[(1E,3E,5E)-6-[(2R,3R,3aR,4R,5R,6aS)-5-Ethylhexahydro-3,4-dihydroxy-3a,4-dimethylfuro[2,3-b]furan-2-yl]-1,3,5-hexatrien-1-yl]-4-methoxy-5-methyl-2H-pyran-2-one

SDS

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