(Q105337915)

English

methyl 2-[(1R,2S,5R,6R,11R,13S,14R)-14-acetyloxy-6-(furan-3-yl)-1,5,15,15-tetramethyl-8,17-dioxo-7-oxatetracyclo[11.3.1.02,11.05,10]heptadec-9-en-16-yl]acetate

group of stereoisomers with the chemical formula C₂₉H₃₆O₈

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

512.241018112 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₉H₃₆O₈

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canonical SMILES

O=C1OC(C2=COC=C2)C3(C(=C1)C4CC5C(=O)C(C)(C4CC3)C(CC(=O)OC)C(C)(C)C5OC(=O)C)C

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isomeric SMILES

COC(=O)CC1C(C)(C)[C@H](OC(C)=O)[C@@H]2C[C@H]3C4=CC(=O)O[C@@H](c5ccoc5)[C@]4(C)CC[C@@H]3[C@@]1(C)C2=O

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found in taxon

Cedrela fissilis

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stated in

Trypanocidal activity of limonoids and triterpenes from Cedrela fissilis.

Identifiers

InChI

InChI=1S/C29H36O8/c1-15(30)36-26-18-11-17-19(29(5,24(18)33)21(27(26,2)3)13-22(31)34-6)7-9-28(4)20(17)12-23(32)37-25(28)16-8-10-35-14-16/h8,10,12,14,17-19,21,25-26H,7,9,11,13H2,1-6H3/t17-,18-,19+,21?,25+,26-,28-,29-/m1/s1

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InChIKey

XOTNOFJPJBDOJJ-FPSCXZSDSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

XOTNOFJPJBDOJJ-FPSCXZSDSA-N

(Q105337915)

methyl 2-[(1R,2S,5R,6R,11R,13S,14R)-14-acetyloxy-6-(furan-3-yl)-1,5,15,15-tetramethyl-8,17-dioxo-7-oxatetracyclo[11.3.1.02,11.05,10]heptadec-9-en-16-yl]acetate

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Identifiers

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