
CAS Number19086-75-0
SynonymsExact Mass 632.06500; PSA 321.66000; Index of Refraction 1.855; Synthetic Route; castalagin; CAS#:24312-00-3; ~81%; Castalin; CAS#:19086-75-0; vescalagin; CAS#:36001-47-5; ~32%; ~%; Precursor & DownStream; Precursor 3; CAS#:108449-60-1; ellagitannin; DownStream 0; Synonyms
Molecular FormulaC27H20O18
Molecular Weight632.437
Density2.047g/cm3
Boiling Point1423.6ºC at 760 mmHg
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 19086-75-0 |
| Catalog No. | 2A-0202580 |
| Chinese Name | Castalin |
| Synonyms | Exact Mass 632.06500; PSA 321.66000; Index of Refraction 1.855; Synthetic Route; castalagin; CAS#:24312-00-3; ~81%; Castalin; CAS#:19086-75-0; vescalagin; CAS#:36001-47-5; ~32%; ~%; Precursor & DownStream; Precursor 3; CAS#:108449-60-1; ellagitannin; DownStream 0; Synonyms |
| Molecular Formula | C27H20O18 |
| Molecular Weight | 632.437 |
| Density | 2.047g/cm3 |
| Boiling Point | 1423.6ºC at 760 mmHg |
| SMILES | OCC1OC(=O)c2cc(O)c(O)c(O)c2c3c(O)c(O)c(O)c4c3C(=O)OC(C1O)C5OC(=O)c6c(C5O)c(O)c(O)c(O)c46 |
| InChI | InChI=1S/C27H20O18/c28-2-5-14(31)23-24-20(37)12-11(27(42)45-24)9(18(35)22(39)19(12)36)8-10(26(41)44-23)7(16(33)21(38)17(8)34)6-3(25(40)43-5)1-4(29)13(30)15(6)32/h1,5,14,20,23-24,28-39H,2H2 |
| InChI Key | InChIKey=PPUHUWSVCUJGTD-UHFFFAOYSA-N |
| Transport Info | Product name: Castalin |
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