Wikidata

(Q105112420)

English

Acetoxyacetic acid (3S,3aS,4R,5R,5aR,7S,8S,8aR,9R,10R,11aR,12R)-3,5,10,12-tetraacetoxy-8-(benzoyloxy)tetradecahydro-5a-hydroxy-2,2,4,7-tetramethyl-4,10-methano-1-oxo-1H-dicyclopenta[a,e]cyclononene-9-yl ester

chemical compound

In more languages

Statements

mass
772.294235456 dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₉H₄₈O₁₆
0 references
canonical SMILES
O=C(OC1C(C)CC2(O)C(OC(=O)C)C3(C)C(OC(=O)C)C(OC(=O)C)(CC4C(=O)C(C)(C)C(OC(=O)C)C43)C(OC(=O)COC(=O)C)C12)C=5C=CC=CC5
0 references
isomeric SMILES
CC(=O)OCC(=O)O[C@@H]1[C@H]2[C@@H](OC(=O)c3ccccc3)[C@@H](C)C[C@]2(O)[C@H](OC(C)=O)[C@@]2(C)[C@H]3[C@H](OC(C)=O)C(C)(C)C(=O)[C@@H]3C[C@]1(OC(C)=O)[C@@H]2OC(C)=O
0 references

Identifiers

 
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