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(Q115946731)
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English
ZUJZTVOVDKEJKY-UHFFFAOYSA-N
group of stereoisomers with the chemical formula C₄₄H₆₄O₁₇
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Statements
instance of
group of stereoisomers
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subclass of
chemical compound
0 references
mass
864.414350588
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₄₄H₆₄O₁₇
0 references
canonical SMILES
O=CC1(C)CC(OC(=O)C)C2(C)CCC3(C(=CC(=O)C4C5(C)CCC(OC6OC(C(=O)O)C(O)C(O)C6OC7OC(C(=O)O)C(O)C(O)C7O)C(C)(C)C5CCC43C)C2C1)C
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found in taxon
Glycyrrhiza inflata
1 reference
stated in
Hepatoprotective triterpene saponins from the roots of Glycyrrhiza inflata.
Identifiers
InChI
InChI=1S/C44H64O17/c1-19(46)57-25-17-40(4,18-45)16-21-20-15-22(47)34-42(6)11-10-24(39(2,3)23(42)9-12-44(34,8)43(20,7)14-13-41(21,25)5)58-38-33(29(51)28(50)32(60-38)36(55)56)61-37-30(52)26(48)27(49)31(59-37)35(53)54/h15,18,21,23-34,37-38,48-52H,9-14,16-17H2,1-8H3,(H,53,54)(H,55,56)
0 references
InChIKey
ZUJZTVOVDKEJKY-UHFFFAOYSA-N
0 references
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