CAS | 52151-92-5 |
Synonyms | (+)-Regiomontanin |
IUPAC Name | 4-[(3S,3aR,6S,6aR)-3-(1,3-benzodioxol-5-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2-methoxyphenol |
Molecular Weight | 356.4 |
Molecular Formula | C20H20O6 |
Canonical SMILES | COC1=C(C=CC(=C1)C2C3COC(C3CO2)C4=CC5=C(C=C4)OCO5)O |
InChI | InChI=1S/C20H20O6/c1-22-17-6-11(2-4-15(17)21)19-13-8-24-20(14(13)9-23-19)12-3-5-16-18(7-12)26-10-25-16/h2-7,13-14,19-21H,8-10H2,1H3/t13-,14-,19+,20+/m0/s1 |
InChI Key | VBIRCRCPHNUJAS-AFHBHXEDSA-N |
Boiling Point | 527.5±50.0 °C |
Purity | 98% |
Density | 1.334±0.06 g/ml |
pKa | 9.84±0.35 |
Appearance | Powder |
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