ChemicalBook--->CAS DataBase List--->130848-06-5

130848-06-5

130848-06-5 Structure

130848-06-5 Structure
IdentificationBack Directory
[Name]

DECURSINOL ANGELATE
[CAS]

130848-06-5
[Synonyms]

Acutilobin
Decursinol mebutate
DECURSINOL ANGELATE
2-Butenoic acid, 2-methyl-, (7S)-7,8-dihydro-8,8-dimethyl-2-oxo-2H,6H-benzo[1,2-b:5,4-b']dipyran-7-yl ester, (2Z)-
[Molecular Formula]

C19H20O5
[MDL Number]

MFCD06796687
[MOL File]

130848-06-5.mol
[Molecular Weight]

328.36
Chemical PropertiesBack Directory
[Melting point ]

93-94 °C
[Boiling point ]

469.4±45.0 °C(Predicted)
[density ]

1.24±0.1 g/cm3(Predicted)
[storage temp. ]

4°C, protect from light
[solubility ]

DMF: 10 mg/ml; DMF:PBS(pH 7.2)(1:1): 0.5 mg/ml; DMSO: 2 mg/ml; Ethanol: 1 mg/ml
[form ]

A crystalline solid
[color ]

White to off-white
[InChI]

1S/C19H20O5/c1-5-11(2)18(21)23-16-9-13-8-12-6-7-17(20)22-14(12)10-15(13)24-19(16,3)4/h5-8,10,16H,9H2,1-4H3/b11-5-/t16-/m0/s1
[InChIKey]

AGABNGOXUSXQDD-XKGFZTIGSA-N
[SMILES]

[o]1c2c(cc3c(c2)OC([C@H](C3)OC(=O)\C(=C/C)\C)(C)C)cc[c]1=O
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P321-P362+P364-P332+P313-P337+P313-P403+P233-P405-P501
[WGK Germany ]

WGK 3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Uses]

Decursinol angelate, a cytotoxic and protein kinase C (PKC) activating agent from the root of Angelica gigas, possesses anti-tumor and anti-inflammatory activities[1][2].
[Biological Activity]

Decursinol Angelate is a pyranocoumarin isolated from medical plant Angelica gigas th at exhibits potent anti-inflammatory properties. Decursinol Angelate appears to suppress type 17 helper T (Th17) cell responses in dextran sodium sulfate-induced colitis model. Decursinol Angelate reduces the production of NF-KB and COX-2 induced proinflammatory cytokine levels on TPA induced mice ear edema.
[References]

[1] Ahn KS, et al. Decursinol angelate: a cytotoxic and protein kinase C activating agent from the root of Angelica gigas. Planta Med. 1997 Aug;63(4):360-1. DOI:10.1055/s-2006-957701
[2] Lee S, et al. Anti-tumor activities of decursinol angelate and decursin from Angelica gigas. Arch Pharm Res. 2003 Sep;26(9):727-30. DOI:10.1007/BF02976682
Spectrum DetailBack Directory
[Spectrum Detail]

DECURSINOL ANGELATE(130848-06-5)1HNMR
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