| Identification | Back Directory | [Name]
(4aR)-3,4,4aβ,5,6,7,8,8a-Octahydro-8aβ-vinyl-5β-hydroxy-7β-[(2-hydroxymethyl-1-oxo-2-propenyl)oxy]-α,4-bis(methylene)-3-oxo-1H-2-benzopyran-6α-acetic acid methyl ester | [CAS]
65388-17-2 | [Synonyms]
Vernodalol
(4aR)-3,4,4aβ,5,6,7,8,8a-Octahydro-8aβ-vinyl-5β-hydroxy-7β-[(2-hydroxymethyl-1-oxo-2-propenyl)oxy]-α,4-bis(methylene)-3-oxo-1H-2-benzopyran-6α-acetic acid methyl ester
1H-2-Benzopyran-6-acetic acid, 8a-ethenyloctahydro-5-hydroxy-7-[[2-(hydroxymethyl)-1-oxo-2-propen-1-yl]oxy]-α,4-bis(methylene)-3-oxo-, methyl ester, (4aR,5R,6S,7S,8aR)- | [Molecular Formula]
C20H24O8 | [MDL Number]
MFCD24849314 | [MOL File]
65388-17-2.mol | [Molecular Weight]
392.4 |
| Chemical Properties | Back Directory | [storage temp. ]
-20°C | [form ]
solid | [Major Application]
metabolomics
vitamins, nutraceuticals, and natural products | [InChI]
1S/C20H24O8/c1-6-20-7-13(28-17(23)10(2)8-21)14(11(3)18(24)26-5)16(22)15(20)12(4)19(25)27-9-20/h6,13-16,21-22H,1-4,7-9H2,5H3/t13-,14+,15+,16-,20+/m0/s1 | [InChIKey]
FZALQGCQQJLGKE-BBNZOYGDSA-N | [SMILES]
COC(=O)C(=C)[C@H]1[C@H](O)[C@H]2C(=C)C(=O)OC[C@]2(C[C@@H]1OC(=O)C(=C)CO)C=C |
| Hazard Information | Back Directory | [Uses]
Vernodalol is an anti-trypanosomatid and is shown to enhance TRAIL-induced apoptosis in large B-cell lymphoma cells. | [Definition]
ChEBI: Vernodalol is a sesquiterpenoid. |
|
| Company Name: |
Merck KGaA
|
| Tel: |
21-20338288 |
| Website: |
www.sigmaaldrich.cn |
|