ChemicalBook--->CAS DataBase List--->53043-28-0

53043-28-0

53043-28-0 Structure

53043-28-0 Structure
IdentificationBack Directory
[Name]

AUSTDIOL
[CAS]

53043-28-0
[Synonyms]

AUSTDIOL
Austadiol
Austidiol
Austdiol >=95% (LC/MS-ELSD)
(7R)-7,8-Dihydro-7α,8β-dihydroxy-3,7-dimethyl-6-oxo-6H-2-benzopyran-5-carbaldehyde
(7R,8S)-7,8-Dihydro-7,8-dihydroxy-3,7-dimethyl-6-oxo-6H-2-benzopyran-5-carbaldehyde
6H-2-Benzopyran-5-carboxaldehyde, 7,8-dihydro-7,8-dihydroxy-3,7-dimethyl-6-oxo-, (7R,8S)-
[Molecular Formula]

C12H12O5
[MDL Number]

MFCD00133114
[MOL File]

53043-28-0.mol
[Molecular Weight]

236.22
Chemical PropertiesBack Directory
[storage temp. ]

-20°C
[form ]

solid
[Major Application]

metabolomics
vitamins, nutraceuticals, and natural products
[InChI]

1S/C12H12O5/c1-6-3-7-8(4-13)10(14)12(2,16)11(15)9(7)5-17-6/h3-5,11,15-16H,1-2H3/t11-,12-/m0/s1
[InChIKey]

QVMUHZHZYCDMAI-RYUDHWBXSA-N
[SMILES]

O1C=C2[C@@H]([C@](C(=O)C(=C2C=C1C)C=O)(O)C)O
Safety DataBack Directory
[Symbol(GHS) ]

Skull and Crossbones (GHS06)Health Hazard (GHS08)
GHS06,GHS08
[Signal word ]

Danger
[Hazard statements ]

H301-H360
[Precautionary statements ]

P201-P301+P310-P308+P313
[Hazard Codes ]

T
[Risk Statements ]

60-25
[Safety Statements ]

36/37-45
[RIDADR ]

3172
[WGK Germany ]

3
[HazardClass ]

6.1(b)
[PackingGroup ]

III
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Acute Tox. 3 Oral
Repr. 1B
Hazard InformationBack Directory
[Uses]

metabolomics
vitamins, nutraceuticals, and natural products
[Definition]

ChEBI: Austdiol is an azaphilone.
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