Wikidata

(Q82981649)

English

20-Ethyl-3,8,13,15-tetrahydroxy-1,6,16-trimethoxy-4-(methoxymethyl)aconitan-14-yl benzoate--hydrogen bromide (1/1)

group of stereoisomers with the chemical formula C₃₂H₄₆BrNO₁₀

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Statements

mass
683.230508772 dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₂H₄₆BrNO₁₀
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
Br.CCN1CC2(COC)C(O)CC(OC)C34C5CC6(O)C(OC)C(O)C(O)(C5C6OC(=O)c5ccccc5)C(C(OC)C23)C14
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
Br.CCN1CC2(COC)C(O)CC(OC)C34[C@@H]5C[C@]6(O)C(OC(=O)c7ccccc7)[C@@H]5[C@@](O)(C(C(OC)[C@H]23)[C@@H]14)C(O)[C@@H]6OC
1 reference
based on heuristic
inferred from InChI

Identifiers

 
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