[(2R,2aS,4aR,7R,7aS,7bR)-3-formyl-2a,4a,7-trihydroxy-6,6,7b-trimethyl-2,5,7,7a-tetrahydro-1H-cyclobuta[e]inden-2-yl] 2-hydroxy-4-methoxy-6-methylbenzoate
Modify Date: 2025-09-30 16:30:24
![[(2R,2aS,4aR,7R,7aS,7bR)-3-formyl-2a,4a,7-trihydroxy-6,6,7b-trimethyl-2,5,7,7a-tetrahydro-1H-cyclobuta[e]inden-2-yl] 2-hydroxy-4-methoxy-6-methylbenzoate Structure](https://image.chemsrc.com/caspic/260/112471-07-5.png)
[(2R,2aS,4aR,7R,7aS,7bR)-3-formyl-2a,4a,7-trihydroxy-6,6,7b-trimethyl-2,5,7,7a-tetrahydro-1H-cyclobuta[e]inden-2-yl] 2-hydroxy-4-methoxy-6-methylbenzoate structure
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Common Name | [(2R,2aS,4aR,7R,7aS,7bR)-3-formyl-2a,4a,7-trihydroxy-6,6,7b-trimethyl-2,5,7,7a-tetrahydro-1H-cyclobuta[e]inden-2-yl] 2-hydroxy-4-methoxy-6-methylbenzoate | ||
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| CAS Number | 112471-07-5 | Molecular Weight | 446.49000 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C24H30O8 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | [(2R,2aS,4aR,7R,7aS,7bR)-3-formyl-2a,4a,7-trihydroxy-6,6,7b-trimethyl-2,5,7,7a-tetrahydro-1H-cyclobuta[e]inden-2-yl] 2-hydroxy-4-methoxy-6-methylbenzoate |
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| Synonym | More Synonyms |
| Molecular Formula | C24H30O8 |
|---|---|
| Molecular Weight | 446.49000 |
| Exact Mass | 446.19400 |
| PSA | 133.52000 |
| LogP | 1.65270 |
| Vapour Pressure | 7.41E-17mmHg at 25°C |
| InChIKey | PETDNGRBYPTDNI-QSNWBFGMSA-N |
| SMILES | COc1cc(C)c(C(=O)OC2CC3(C)C4C(O)C(C)(C)CC4(O)C=C(C=O)C23O)c(O)c1 |
| Benzoic acid,2-hydroxy-4-methoxy-6-methyl-,3-formyl-2,2a,4a,5,6,7,7a,7b-octahydro-2a,4a,7-trihydroxy-6,6,7b-trimethyl-1H-cyclobut(e)inden-2-yl ester,(2R-(2alpha,2abeta,4aalpha,7beta,7aalpha,7bbeta)) |
| 4'-Methylmelledonal |