ChemicalBook--->CAS DataBase List--->94596-27-7

94596-27-7

94596-27-7 Structure

94596-27-7 Structure
IdentificationBack Directory
[Name]

Senkyunolide H
[CAS]

94596-27-7
[Synonyms]

Senkyunolide H
Dimethyl 3-oxo-3H-pyrrolo[2,1,5-de]quinolizine-1,2-dicarboxylate
(3Z,6R,7S)-rel-3-Butylidene-4,5,6,7-tetrahydro-6,7-dihydroxy-1(3H)-isobenzofuranone
1(3H)-Isobenzofuranone, 3-butylidene-4,5,6,7-tetrahydro-6,7-dihydroxy-, (3Z,6R,7S)-rel-
[Molecular Formula]

C12H16O4
[MDL Number]

MFCD32182625
[MOL File]

94596-27-7.mol
[Molecular Weight]

224.25
Chemical PropertiesBack Directory
[Boiling point ]

444.8±45.0 °C(Predicted)
[density ]

1.28
[storage temp. ]

2-8°C
[solubility ]

Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
[form ]

Oil
[pka]

12.78±0.40(Predicted)
[color ]

White to off-white
[InChI]

InChI=1/C12H16O4/c1-2-3-4-9-7-5-6-8(13)11(14)10(7)12(15)16-9/h4,8,11,13-14H,2-3,5-6H2,1H3/b9-4-/t8-,11-/s3
[InChIKey]

DQNGMIQSXNGHOA-SQTOKDDWNA-N
[SMILES]

C1(=O)C2=C(CC[C@@H](O)[C@H]2O)/C(=C/CCC)/O1 |&1:6,8,r|
Hazard InformationBack Directory
[Chemical Properties]

A slightly yellow oily substance, soluble in organic solvents such as methanol, ethanol, and DMSO, derived from the rhizome of Chuanxiong.
[Uses]

Senkyunolide H is a phthalide isolated from the rhizome of Ligusticum chuanxiong Hort. Senkyunolide H has been reported to have several pharmacological activities, including anti-?atherosclerotic, antiproliferative, and cytoprotective effects. senkyunolide H protects against MPP+-induced apoptosis via the ROS-mediated mitogen-activated protein kinase pathway in PC12 cells.
[Definition]

ChEBI: Senkyunolide h is a member of 2-benzofurans.
Spectrum DetailBack Directory
[Spectrum Detail]

Senkyunolide H(94596-27-7)1HNMR
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