CAS Number7242-04-8
SynonymsPentaacetylgitoxin; Penta-O-acetyl-gitoxin; Penta-O-acetyl-D-gluco-heptulose-phenylosazon; gitoxin-16-acetate; penta-O-acetyl-aldehydo-keto-D-gluco-[2]heptosulose bis-phenylhydrazone
Molecular FormulaC51H74O19
Molecular Weight991.12200
Purity98.00%
Density1.3g/cm3
Boiling Point923.5ºC at 760mmHg
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 7242-04-8 |
| Catalog No. | 2A-9011914 |
| Chinese Name | [(3S,5R,8R,9S,10S,13R,14S,16S,17R)-3-[(2R,4S,5R,6R)-4-acetoxy-5-[ (2S,4S,5R,6R)-4-acetoxy-5-[(2S,4S, |
| Synonyms | Pentaacetylgitoxin; Penta-O-acetyl-gitoxin; Penta-O-acetyl-D-gluco-heptulose-phenylosazon; gitoxin-16-acetate; penta-O-acetyl-aldehydo-keto-D-gluco-[2]heptosulose bis-phenylhydrazone |
| Molecular Formula | C51H74O19 |
| Molecular Weight | 991.12200 |
| Purity | 98.00 |
| Density | 1.3g/cm3 |
| Boiling Point | 923.5ºC at 760mmHg |
| SMILES | CC(=O)OC1CC(OC2C(C)OC(OC3C(C)OC(OC4CCC5(C)C(CCC6C5CCC5(C)C(C7=CC(=O)OC7)C(OC(C)=O)CC65O)C4)CC3OC(C)=O)CC2OC(C)=O)OC(C)C1OC(C)=O |
| InChI | InChI=1S/C51H74O19/c1-24-46(67-31(8)56)37(63-27(4)52)20-43(61-24)69-48-26(3)62-44(21-39(48)65-29(6)54)70-47-25(2)60-42(19-38(47)64-28(5)53)68-34-13-15-49(9)33(18-34)11-12-36-35(49)14-16-50(10)45(32-17-41(57)59-23-32)40(66-30(7)55)22-51(36,50)58/h17,24-26,33-40,42-48,58H,11-16,18-23H2,1-10H3 |
| InChI Key | JDYLJSDIEBHXPO-ALNZGLKXSA-N |
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