| Identification | Back Directory | [Name]
phomopsolide B | [CAS]
97529-84-5 | [Synonyms]
phomopsolide B
(6S)-5,6-Dihydro-6α-[(1E,3S,4S)-3,4-dihydroxy-1-pentenyl]-5α-[(E)-2-methyl-2-butenoyloxy]-2H-pyran-2-one
(E)-(2S,3S)-2-((3S,4S,E)-3,4-dihydroxypent-1-en-1-yl)-6-oxo-3,6-dihydro-2H-pyran-3-yl 2-methylbut-2-enoate
2-Butenoic acid, 2-methyl-, (2S,3S)-2-[(1E,3S,4S)-3,4-dihydroxy-1-penten-1-yl]-3,6-dihydro-6-oxo-2H-pyran-3-yl ester, (2E)- | [Molecular Formula]
C15H20O6 | [MOL File]
97529-84-5.mol | [Molecular Weight]
296.32 |
| Chemical Properties | Back Directory | [Boiling point ]
508.4±50.0 °C(Predicted) | [density ]
1.23±0.1 g/cm3(Predicted) | [storage temp. ]
-20°C | [solubility ]
water: soluble | [form ]
solid | [pka]
13.71±0.20(Predicted) | [biological source]
plant | [Water Solubility ]
water: soluble | [Major Application]
metabolomics
vitamins, nutraceuticals, and natural products | [InChI]
1S/C15H20O6/c1-4-9(2)15(19)21-13-7-8-14(18)20-12(13)6-5-11(17)10(3)16/h4-8,10-13,16-17H,1-3H3/b6-5+,9-4+/t10-,11-,12-,13-/m0/s1 | [InChIKey]
JTHHOHSDOJJNFN-HIWLEQICSA-N | [SMILES]
O1[C@H]([C@H](C=CC1=O)OC(=O)\C(=C\C)\C)\C=C\[C@H](O)[C@@H](O)C |
| Hazard Information | Back Directory | [Uses]
It is a natural product derived from plant source th at finds application in compound screening libraries, metabolomics, phytochemical, and pharmaceutical research. |
|
| Company Name: |
Merck KGaA
|
| Tel: |
21-20338288 |
| Website: |
www.sigmaaldrich.cn |
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