(Q105241255)

English

[(1S,2R,4S,7R,8R,12R,19R)-7-(2-hydroxy-5-oxo-2H-furan-4-yl)-1,8,12,16,16-pentamethyl-5,15-dioxo-3,6-dioxapentacyclo[9.8.0.02,4.02,8.012,17]nonadec-13-en-19-yl] acetate

group of stereoisomers with the chemical formula C₂₈H₃₄O₉

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

514.220282668 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₈H₃₄O₉

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canonical SMILES

O=C1OC(O)C=C1C2OC(=O)C3OC34C2(C)CCC5C6(C=CC(=O)C(C)(C)C6CC(OC(=O)C)C54C)C

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isomeric SMILES

CC(=O)O[C@@H]1CC2C(C)(C)C(=O)C=C[C@]2(C)C2CC[C@]3(C)[C@H](C4=CC(O)OC4=O)OC(=O)[C@H]4O[C@]43[C@@]21C

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found in taxon

Carapa guianensis

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stated in

Effect of triterpenoids and limonoids isolated from Cabralea canjerana and Carapa guianensis (Meliaceae) against Spodoptera frugiperda (J. E. Smith).

Identifiers

InChI

InChI=1S/C28H34O9/c1-13(29)34-18-12-16-24(2,3)17(30)8-9-25(16,4)15-7-10-26(5)20(14-11-19(31)35-22(14)32)36-23(33)21-28(26,37-21)27(15,18)6/h8-9,11,15-16,18-21,31H,7,10,12H2,1-6H3/t15?,16?,18-,19?,20+,21-,25-,26-,27+,28-/m1/s1

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InChIKey

RNDCBBAMBNUYHC-NFORPDTKSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

RNDCBBAMBNUYHC-NFORPDTKSA-N

(Q105241255)

[(1S,2R,4S,7R,8R,12R,19R)-7-(2-hydroxy-5-oxo-2H-furan-4-yl)-1,8,12,16,16-pentamethyl-5,15-dioxo-3,6-dioxapentacyclo[9.8.0.02,4.02,8.012,17]nonadec-13-en-19-yl] acetate

Statements

Identifiers

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