loading...| Preferred Name |
Sucrose octaacetate |
|
| Synonyms |
[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[(2S,3S,4R,5R)-3,4-diacetyloxy-2,5-bis(acetyloxymethyl)oxolan-2-yl]oxyoxan-2-yl]methyl acetate |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_180783 |
|
| charge |
0 |
|
| database_cross_reference |
KEGG:D05935 CAS:126-14-7 Chemspider:29073 |
|
| formula |
C28H38O19 |
|
| has_exact_synonym |
[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[(2S,3S,4R,5R)-3,4-diacetyloxy-2,5-bis(acetyloxymethyl)oxolan-2-yl]oxyoxan-2-yl]methyl acetate |
|
| has_obo_namespace |
chebi_ontology |
|
| id |
CHEBI:180783 |
|
| in_subset | ||
| inchi |
InChI=1S/C28H38O19/c1-12(29)37-9-20-22(40-15(4)32)24(42-17(6)34)25(43-18(7)35)27(45-20)47-28(11-39-14(3)31)26(44-19(8)36)23(41-16(5)33)21(46-28)10-38-13(2)30/h20-27H,9-11H2,1-8H3/t20-,21-,22-,23-,24+,25-,26+,27-,28+/m1/s1 |
|
| inchikey |
ZIJKGAXBCRWEOL-SAXBRCJISA-N |
|
| label |
Sucrose octaacetate |
|
| mass |
678.593 |
|
| monoisotopicmass |
678.20073 |
|
| notation |
CHEBI:180783 |
|
| prefLabel |
Sucrose octaacetate |
|
| smiles |
O1[C@@](O[C@H]2O[C@@H]([C@@H](OC(=O)C)[C@H](OC(=O)C)[C@H]2OC(=O)C)COC(=O)C)([C@@H](OC(=O)C)[C@H](OC(=O)C)[C@H]1COC(=O)C)COC(=O)C |
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| treeView | ||
| subClassOf |