Introduction：Basic information about CAS 21671-00-1|shoreic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | shoreic acid |
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| CAS Number | 21671-00-1 | Molecular Weight | 474.72 |
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| Density | 1.0±0.1 g/cm3 | Boiling Point | 568.3±45.0 °C at 760 mmHg |
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| Molecular Formula | C30H50O4 | Melting Point | / |
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| MSDS | / | Flash Point | 174.3±22.2 °C |
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Names
| Name | 3-{(3S,3aR,5aR,6S,7S,9aR,9bR)-3-[(2S,5R)-5-(2-Hydroxy-2-propanyl) -2-methyltetrahydro-2-furanyl]-7-isopropenyl-6,9a,9b-trimethyldod ecahydro-1H-cyclopenta[a]naphthalen-6-yl}propanoic acid |
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| Synonym | More Synonyms |
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shoreic acid BiologicalActivity
| Description | Shoreic acid (compound 8a) is a dammarane skeleton compound isolated from Cabralea eichleriana DC[1]. |
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| Related Catalog | Research Areas >>OthersSignaling Pathways >>Others >>Others |
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| References | [1]. M.M. Rao, et al. Cabralea eichleriana dc. (meliaceae)—I structure and stereochemistry of wood extractives. Tetrahedron. 1975, 31, 4. |
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Chemical & Physical Properties
| Density | 1.0±0.1 g/cm3 |
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| Boiling Point | 568.3±45.0 °C at 760 mmHg |
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| Molecular Formula | C30H50O4 |
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| Molecular Weight | 474.72 |
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| Flash Point | 174.3±22.2 °C |
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| Exact Mass | 474.370911 |
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| PSA | 66.76000 |
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| LogP | 7.99 |
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| Vapour Pressure | 0.0±3.5 mmHg at 25°C |
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| Index of Refraction | 1.514 |
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| InChIKey | ZKBGKWZSOPPDSD-UHFFFAOYSA-N |
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| SMILES | C=C(C)C1CCC2(C)C(CCC3C(C4(C)CCC(C(C)(C)O)O4)CCC32C)C1(C)CCC(=O)O |
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Safety Information
Synonyms
| 3,4-Secodammar-4(28)-en-3-oic acid, 20,24-epoxy-25-hydroxy-, (24R)- |
| 1H-Benz[e]indene-6-propanoic acid, dodecahydro-6,9a,9b-trimethyl-7-(1-methylethenyl)-3-[(2S,5R)-tetrahydro-5-(1-hydroxy-1-methylethyl)-2-methyl-2-furanyl]-, (3S,3aR,5aR,6S,7S,9aR,9bR)- |
| schoreic acid |
| shoreic acid |
| Schoellkopf's reagent |
| 3-{(3S,3aR,5aR,6S,7S,9aR,9bR)-3-[(2S,5R)-5-(2-Hydroxy-2-propanyl)-2-methyltetrahydro-2-furanyl]-7-isopropenyl-6,9a,9b-trimethyldodecahydro-1H-cyclopenta[a]naphthalen-6-yl}propanoic acid |
