(Q104985533)

English

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

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

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

1 reference

based on heuristic

inferred from SMILES

mass

468.214803364 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₇H₃₂O₇

0 references

canonical SMILES

O=C(OC)CC1C(C(=O)C2C(=O)C1(C)C3C(=C4CC(=O)OC(C5=COC=C5)C4(C)CC3)C2)(C)C

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isomeric SMILES

COC(=O)C[C@@H]1C(C)(C)C(=O)[C@@H]2CC3=C4CC(=O)O[C@@H](c5ccoc5)[C@]4(C)CC[C@@H]3[C@@]1(C)C2=O

0 references

found in taxon

Swietenia mahagoni

1 reference

stated in

Structurally diverse limonoids from the fruits of Swietenia mahagoni.

Identifiers

InChI

InChI=1S/C27H32O7/c1-25(2)19(12-20(28)32-5)27(4)17-6-8-26(3)18(15(17)10-16(22(25)30)23(27)31)11-21(29)34-24(26)14-7-9-33-13-14/h7,9,13,16-17,19,24H,6,8,10-12H2,1-5H3/t16-,17-,19+,24-,26+,27+/m0/s1

0 references

InChIKey

DNFJSIPZGYBGON-WDXIATPISA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

DNFJSIPZGYBGON-WDXIATPISA-N

(Q104985533)

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

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