| Identification | Back Directory | [Name]
Tokinolide B | [CAS]
112966-16-2 | [Synonyms]
3A':8
6'R)-3
(3'Z)-(3S
Tokinolide B
[(3'Z)-(3S,8R,3A'S,6'R)-3,3A'
(3'Z)-(3S,8R,3a'S,6'R)-3,3a':8,6'-Diligustilide
Spiro[3H-3a,6-ethanoisobenzofuran-4(1H),1'(3'H)-isobenzofuran]-1,3'-dione,3-butylidene-5,6,6',7'-tetrahydro-5-propyl-, (1'S,3Z,3aS,5R,6R)- | [Molecular Formula]
C24H28O4 | [MDL Number]
MFCD32003967 | [MOL File]
112966-16-2.mol | [Molecular Weight]
380.48 |
| Chemical Properties | Back Directory | [Boiling point ]
644.2±55.0 °C(Predicted) | [density ]
1.23±0.1 g/cm3(Predicted) | [storage temp. ]
-20°C, protect from light | [solubility ]
Soluble in DMSO | [form ]
Solid | [color ]
White to off-white | [InChIKey]
DZMFTLLDUYBHLI-MUSNRYMWSA-N | [SMILES]
C1(=O)C2[C@@]3(CC[C@]([H])(C=2)[C@@H](CCC)[C@@]23C3=C(C=CCC3)C(=O)O2)/C(=C/CCC)/O1 |
| Hazard Information | Back Directory | [Uses]
Tokinolide B is isolated from the rhizomes of Ligusticum porter[1]. | [storage]
-20°C, protect from light | [References]
[1] León A, et al. Phthalides and other constituents from Ligusticum porteri; sedative and spasmolytic activities of some natural products and derivatives. Nat Prod Res. 2011 Aug;25(13):1234-42. DOI:10.1080/14786419.2010.534735 |
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