(Q105126592)

English

[(1S,2R,4S,5R,9R,10R,13R,14S,15S,17R)-9-(furan-3-yl)-15-(2-methoxy-2-oxoethyl)-10,14,16,16-tetramethyl-7,18-dioxo-3,8-dioxapentacyclo[12.3.1.02,4.04,13.05,10]octadecan-17-yl] 2-methylbutanoate

group of stereoisomers with the chemical formula C₃₂H₄₂O₉

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Statements

instance of

group of stereoisomers

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subclass of

(1S,2R,4S,9R,10R,13R,14S,15S,17R)-9-(furan-3-yl)-15-(2-methoxy-2-oxoethyl)-10,14,16,16-tetramethyl-7,18-dioxo-3,8-dioxapentacyclo[12.3.1.0²,⁴.0⁴,¹³.0⁵,¹⁰]octadecan-17-yl 2-methylbutanoate

1 reference

based on heuristic

inferred from SMILES

mass

570.282882924 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₂H₄₂O₉

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canonical SMILES

O=C(OC)CC1C2(C(=O)C(C(OC(=O)C(C)CC)C1(C)C)C3OC34C5CC(=O)OC(C6=COC=C6)C5(C)CCC42)C

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isomeric SMILES

CCC(C)C(=O)O[C@@H]1[C@@H]2C(=O)[C@@](C)([C@@H](CC(=O)OC)C1(C)C)[C@H]1CC[C@@]3(C)[C@H](c4ccoc4)OC(=O)C[C@H]3[C@]13O[C@H]23

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found in taxon

Cipadessa baccifera

1 reference

stated in

Trypanocidal activity of flavonoids and limonoids isolated from Myrsinaceae and Meliaceae active plant extracts

Identifiers

InChI

InChI=1S/C32H42O9/c1-8-16(2)28(36)40-26-23-24(35)31(6,19(29(26,3)4)13-21(33)37-7)18-9-11-30(5)20(32(18)27(23)41-32)14-22(34)39-25(30)17-10-12-38-15-17/h10,12,15-16,18-20,23,25-27H,8-9,11,13-14H2,1-7H3/t16?,18-,19+,20-,23+,25+,26-,27-,30-,31-,32-/m1/s1

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InChIKey

JFCFHKVHDISZHG-PQHIARGRSA-N

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1 reference

17 September 2022

inferred from InChIKey

(Q105126592)

[(1S,2R,4S,5R,9R,10R,13R,14S,15S,17R)-9-(furan-3-yl)-15-(2-methoxy-2-oxoethyl)-10,14,16,16-tetramethyl-7,18-dioxo-3,8-dioxapentacyclo[12.3.1.02,4.04,13.05,10]octadecan-17-yl] 2-methylbutanoate

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Identifiers

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