Wikidata

(Q105034715)

English

(2S,4S,5S)-4-[(1E,3E,5E)-7-[(2R)-6-[(2R,3S,4aR,12bS)-2,3,4a,8,12b-pentahydroxy-3-methyl-1,7,12-trioxo-2,4-dihydrobenzo[a]anthracen-9-yl]-2-methyloxan-3-yl]oxy-7-oxohepta-1,3,5-trienyl]-2,5-dimethyl-1,3-dioxolane-2-carboxylic acid

group of stereoisomers with the chemical formula C₃₈H₄₀O₁₅

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Statements

mass
736.23672058 dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₈H₄₀O₁₅
0 references
canonical SMILES
O=C(OC1CCC(OC1C)C2=CC=C3C(=O)C4=C(C=CC5(O)CC(O)(C)C(O)C(=O)C45O)C(=O)C3=C2O)C=CC=CC=CC6OC(OC6C)(C(=O)O)C
0 references
isomeric SMILES
C[C@@H]1O[C@](C)(C(=O)O)O[C@H]1/C=C/C=C/C=C/C(=O)OC1CCC(c2ccc3c(c2O)C(=O)C2=C(C3=O)[C@@]3(O)C(=O)[C@H](O)[C@@](C)(O)C[C@@]3(O)C=C2)O[C@@H]1C
0 references

Identifiers

 
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